USER MOD reduce.3.24.130724 H: found=0, std=0, add=920, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 918 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 116 TYR OH : rot 165:sc= -1.55! USER MOD Set 1.2: A 117 GLN : amide:sc= -8.67! C(o=-10!,f=-8.4!) USER MOD Set 2.1: A 109 HIS : no HD1:sc= -2.11 X(o=-3.1,f=-2.9) USER MOD Set 2.2: A 110 GLN : amide:sc= -0.991! K(o=-3.1!,f=-2) USER MOD Set 3.1: A 46 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 47 HIS : no HD1:sc= -0.549 K(o=-0.68,f=-3.5) USER MOD Set 3.3: A 50 GLN : amide:sc= -0.131 K(o=-0.68,f=-2.2!) USER MOD Set 4.1: A 8 CYS SG : rot 44:sc= -7.48! USER MOD Set 4.2: A 34 CYS SG : rot 137:sc= -0.137 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 THR OG1 : rot 102:sc= 0.121 USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 20 CYS SG : rot 180:sc= -3.91! USER MOD Single : A 21 GLN : amide:sc= -9.85! C(o=-9.8!,f=-18!) USER MOD Single : A 25 SER OG : rot 20:sc= 0.872 USER MOD Single : A 29 TYR OH : rot 80:sc= -0.432 USER MOD Single : A 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 32 GLN : amide:sc= -0.116 K(o=-0.12,f=-0.78) USER MOD Single : A 36 SER OG : rot -173:sc= -0.556 USER MOD Single : A 39 MET CE :methyl -147:sc= -0.537 (180deg=-2.82!) USER MOD Single : A 43 TYR OH : rot -174:sc= -0.636 USER MOD Single : A 45 GLN : amide:sc= -4.44! C(o=-4.4!,f=-6.7!) USER MOD Single : A 53 CYS SG : rot -16:sc= -0.941! USER MOD Single : A 60 ASN : amide:sc= -0.0575 K(o=-0.057,f=-2.1!) USER MOD Single : A 62 SER OG : rot 180:sc= 0.057 USER MOD Single : A 68 GLN : amide:sc= -0.0919 K(o=-0.092,f=-1.6!) USER MOD Single : A 69 GLN : amide:sc= -1.12 X(o=-1.1,f=-0.79) USER MOD Single : A 71 CYS SG : rot 79:sc= -5.42! USER MOD Single : A 99 TYR OH : rot -7:sc= -0.289 USER MOD Single : A 100 HIS : no HD1:sc= -14.6! C(o=-15!,f=-25!) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 105 HIS : no HD1:sc= -1.5 K(o=-1.5,f=-0.05) USER MOD Single : A 113 GLN : amide:sc= -0.641 K(o=-0.64,f=-2.2!) USER MOD Single : A 133 THR OG1 : rot -150:sc= 0.0519 USER MOD Single : A 134 MET CE :methyl -104:sc=-0.00592 (180deg=-0.0931) USER MOD ----------------------------------------------------------------- ATOM 50 N GLN A 4 3.498 4.812 15.842 1.00 0.00 N ATOM 51 CA GLN A 4 4.327 4.208 14.755 1.00 0.00 C ATOM 52 C GLN A 4 3.453 3.959 13.519 1.00 0.00 C ATOM 53 O GLN A 4 2.241 3.932 13.603 1.00 0.00 O ATOM 54 CB GLN A 4 4.874 2.896 15.335 1.00 0.00 C ATOM 55 CG GLN A 4 5.751 3.215 16.550 1.00 0.00 C ATOM 56 CD GLN A 4 6.488 1.953 17.009 1.00 0.00 C ATOM 57 OE1 GLN A 4 5.875 1.004 17.459 1.00 0.00 O ATOM 58 NE2 GLN A 4 7.789 1.905 16.916 1.00 0.00 N ATOM 0 HA GLN A 4 5.142 4.858 14.437 1.00 0.00 H new ATOM 0 HB2 GLN A 4 4.052 2.241 15.625 1.00 0.00 H new ATOM 0 HB3 GLN A 4 5.454 2.364 14.581 1.00 0.00 H new ATOM 0 HG2 GLN A 4 6.470 3.994 16.296 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.135 3.602 17.362 1.00 0.00 H new ATOM 0 HE21 GLN A 4 8.303 2.701 16.539 1.00 0.00 H new ATOM 0 HE22 GLN A 4 8.292 1.071 17.221 1.00 0.00 H new ATOM 67 N ILE A 5 4.053 3.798 12.371 1.00 0.00 N ATOM 68 CA ILE A 5 3.246 3.574 11.135 1.00 0.00 C ATOM 69 C ILE A 5 3.353 2.115 10.665 1.00 0.00 C ATOM 70 O ILE A 5 4.433 1.584 10.509 1.00 0.00 O ATOM 71 CB ILE A 5 3.860 4.509 10.091 1.00 0.00 C ATOM 72 CG1 ILE A 5 3.694 5.969 10.537 1.00 0.00 C ATOM 73 CG2 ILE A 5 3.153 4.300 8.752 1.00 0.00 C ATOM 74 CD1 ILE A 5 4.365 6.891 9.516 1.00 0.00 C ATOM 0 H ILE A 5 5.064 3.812 12.234 1.00 0.00 H new ATOM 0 HA ILE A 5 2.187 3.771 11.303 1.00 0.00 H new ATOM 0 HB ILE A 5 4.922 4.287 9.985 1.00 0.00 H new ATOM 0 HG12 ILE A 5 2.636 6.216 10.626 1.00 0.00 H new ATOM 0 HG13 ILE A 5 4.139 6.113 11.522 1.00 0.00 H new ATOM 0 HG21 ILE A 5 3.587 4.964 8.004 1.00 0.00 H new ATOM 0 HG22 ILE A 5 3.276 3.265 8.433 1.00 0.00 H new ATOM 0 HG23 ILE A 5 2.092 4.522 8.862 1.00 0.00 H new ATOM 0 HD11 ILE A 5 4.248 7.928 9.830 1.00 0.00 H new ATOM 0 HD12 ILE A 5 5.426 6.649 9.449 1.00 0.00 H new ATOM 0 HD13 ILE A 5 3.899 6.753 8.540 1.00 0.00 H new ATOM 86 N ALA A 6 2.240 1.469 10.413 1.00 0.00 N ATOM 87 CA ALA A 6 2.289 0.058 9.932 1.00 0.00 C ATOM 88 C ALA A 6 2.406 0.052 8.414 1.00 0.00 C ATOM 89 O ALA A 6 1.558 0.571 7.719 1.00 0.00 O ATOM 90 CB ALA A 6 0.961 -0.565 10.352 1.00 0.00 C ATOM 0 H ALA A 6 1.304 1.859 10.520 1.00 0.00 H new ATOM 0 HA ALA A 6 3.137 -0.490 10.342 1.00 0.00 H new ATOM 0 HB1 ALA A 6 0.929 -1.606 10.029 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.864 -0.518 11.437 1.00 0.00 H new ATOM 0 HB3 ALA A 6 0.140 -0.017 9.891 1.00 0.00 H new ATOM 96 N ILE A 7 3.448 -0.511 7.891 1.00 0.00 N ATOM 97 CA ILE A 7 3.598 -0.517 6.415 1.00 0.00 C ATOM 98 C ILE A 7 3.682 -1.945 5.881 1.00 0.00 C ATOM 99 O ILE A 7 4.465 -2.756 6.328 1.00 0.00 O ATOM 100 CB ILE A 7 4.878 0.275 6.163 1.00 0.00 C ATOM 101 CG1 ILE A 7 4.650 1.708 6.641 1.00 0.00 C ATOM 102 CG2 ILE A 7 5.209 0.276 4.672 1.00 0.00 C ATOM 103 CD1 ILE A 7 5.813 2.589 6.200 1.00 0.00 C ATOM 0 H ILE A 7 4.198 -0.964 8.413 1.00 0.00 H new ATOM 0 HA ILE A 7 2.746 -0.074 5.899 1.00 0.00 H new ATOM 0 HB ILE A 7 5.711 -0.178 6.701 1.00 0.00 H new ATOM 0 HG12 ILE A 7 3.715 2.093 6.234 1.00 0.00 H new ATOM 0 HG13 ILE A 7 4.557 1.729 7.727 1.00 0.00 H new ATOM 0 HG21 ILE A 7 6.124 0.844 4.503 1.00 0.00 H new ATOM 0 HG22 ILE A 7 5.350 -0.749 4.330 1.00 0.00 H new ATOM 0 HG23 ILE A 7 4.390 0.734 4.118 1.00 0.00 H new ATOM 0 HD11 ILE A 7 5.646 3.610 6.543 1.00 0.00 H new ATOM 0 HD12 ILE A 7 6.740 2.209 6.629 1.00 0.00 H new ATOM 0 HD13 ILE A 7 5.885 2.579 5.112 1.00 0.00 H new ATOM 115 N CYS A 8 2.865 -2.257 4.924 1.00 0.00 N ATOM 116 CA CYS A 8 2.881 -3.626 4.355 1.00 0.00 C ATOM 117 C CYS A 8 3.604 -3.619 3.012 1.00 0.00 C ATOM 118 O CYS A 8 3.124 -3.069 2.044 1.00 0.00 O ATOM 119 CB CYS A 8 1.410 -3.981 4.168 1.00 0.00 C ATOM 120 SG CYS A 8 1.274 -5.655 3.500 1.00 0.00 S ATOM 0 H CYS A 8 2.184 -1.621 4.509 1.00 0.00 H new ATOM 0 HA CYS A 8 3.398 -4.342 4.993 1.00 0.00 H new ATOM 0 HB2 CYS A 8 0.885 -3.914 5.121 1.00 0.00 H new ATOM 0 HB3 CYS A 8 0.936 -3.269 3.492 1.00 0.00 H new ATOM 0 HG CYS A 8 2.092 -6.443 4.133 1.00 0.00 H new ATOM 126 N ILE A 9 4.759 -4.212 2.940 1.00 0.00 N ATOM 127 CA ILE A 9 5.494 -4.215 1.647 1.00 0.00 C ATOM 128 C ILE A 9 5.523 -5.612 1.028 1.00 0.00 C ATOM 129 O ILE A 9 5.856 -6.585 1.676 1.00 0.00 O ATOM 130 CB ILE A 9 6.907 -3.769 1.998 1.00 0.00 C ATOM 131 CG1 ILE A 9 7.781 -3.829 0.743 1.00 0.00 C ATOM 132 CG2 ILE A 9 7.479 -4.703 3.061 1.00 0.00 C ATOM 133 CD1 ILE A 9 9.231 -3.513 1.108 1.00 0.00 C ATOM 0 H ILE A 9 5.223 -4.691 3.712 1.00 0.00 H new ATOM 0 HA ILE A 9 5.017 -3.563 0.915 1.00 0.00 H new ATOM 0 HB ILE A 9 6.888 -2.749 2.381 1.00 0.00 H new ATOM 0 HG12 ILE A 9 7.717 -4.819 0.291 1.00 0.00 H new ATOM 0 HG13 ILE A 9 7.419 -3.116 0.002 1.00 0.00 H new ATOM 0 HG21 ILE A 9 8.491 -4.388 3.316 1.00 0.00 H new ATOM 0 HG22 ILE A 9 6.852 -4.667 3.952 1.00 0.00 H new ATOM 0 HG23 ILE A 9 7.503 -5.722 2.675 1.00 0.00 H new ATOM 0 HD11 ILE A 9 9.850 -3.557 0.212 1.00 0.00 H new ATOM 0 HD12 ILE A 9 9.288 -2.514 1.540 1.00 0.00 H new ATOM 0 HD13 ILE A 9 9.591 -4.243 1.833 1.00 0.00 H new ATOM 145 N TRP A 10 5.207 -5.710 -0.232 1.00 0.00 N ATOM 146 CA TRP A 10 5.252 -7.040 -0.900 1.00 0.00 C ATOM 147 C TRP A 10 6.356 -7.045 -1.950 1.00 0.00 C ATOM 148 O TRP A 10 6.261 -6.396 -2.975 1.00 0.00 O ATOM 149 CB TRP A 10 3.892 -7.249 -1.566 1.00 0.00 C ATOM 150 CG TRP A 10 3.951 -8.521 -2.359 1.00 0.00 C ATOM 151 CD1 TRP A 10 4.853 -9.516 -2.157 1.00 0.00 C ATOM 152 CD2 TRP A 10 3.108 -8.955 -3.464 1.00 0.00 C ATOM 153 NE1 TRP A 10 4.620 -10.523 -3.074 1.00 0.00 N ATOM 154 CE2 TRP A 10 3.555 -10.227 -3.896 1.00 0.00 C ATOM 155 CE3 TRP A 10 2.013 -8.376 -4.135 1.00 0.00 C ATOM 156 CZ2 TRP A 10 2.937 -10.904 -4.943 1.00 0.00 C ATOM 157 CZ3 TRP A 10 1.388 -9.058 -5.193 1.00 0.00 C ATOM 158 CH2 TRP A 10 1.852 -10.318 -5.598 1.00 0.00 C ATOM 0 H TRP A 10 4.921 -4.932 -0.826 1.00 0.00 H new ATOM 0 HA TRP A 10 5.458 -7.836 -0.185 1.00 0.00 H new ATOM 0 HB2 TRP A 10 3.105 -7.306 -0.814 1.00 0.00 H new ATOM 0 HB3 TRP A 10 3.653 -6.407 -2.215 1.00 0.00 H new ATOM 0 HD1 TRP A 10 5.626 -9.520 -1.403 1.00 0.00 H new ATOM 0 HE1 TRP A 10 5.169 -11.380 -3.135 1.00 0.00 H new ATOM 0 HE3 TRP A 10 1.652 -7.403 -3.835 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 3.294 -11.877 -5.247 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 0.545 -8.609 -5.697 1.00 0.00 H new ATOM 0 HH2 TRP A 10 1.371 -10.834 -6.415 1.00 0.00 H new ATOM 169 N VAL A 11 7.406 -7.768 -1.701 1.00 0.00 N ATOM 170 CA VAL A 11 8.524 -7.816 -2.679 1.00 0.00 C ATOM 171 C VAL A 11 9.021 -9.250 -2.840 1.00 0.00 C ATOM 172 O VAL A 11 9.158 -9.977 -1.877 1.00 0.00 O ATOM 173 CB VAL A 11 9.627 -6.963 -2.062 1.00 0.00 C ATOM 174 CG1 VAL A 11 10.862 -7.022 -2.956 1.00 0.00 C ATOM 175 CG2 VAL A 11 9.155 -5.514 -1.929 1.00 0.00 C ATOM 0 H VAL A 11 7.540 -8.330 -0.860 1.00 0.00 H new ATOM 0 HA VAL A 11 8.219 -7.459 -3.663 1.00 0.00 H new ATOM 0 HB VAL A 11 9.871 -7.346 -1.071 1.00 0.00 H new ATOM 0 HG11 VAL A 11 11.655 -6.414 -2.521 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.201 -8.055 -3.041 1.00 0.00 H new ATOM 0 HG13 VAL A 11 10.613 -6.640 -3.946 1.00 0.00 H new ATOM 0 HG21 VAL A 11 9.949 -4.912 -1.487 1.00 0.00 H new ATOM 0 HG22 VAL A 11 8.906 -5.120 -2.915 1.00 0.00 H new ATOM 0 HG23 VAL A 11 8.273 -5.476 -1.290 1.00 0.00 H new ATOM 185 N GLU A 12 9.313 -9.666 -4.037 1.00 0.00 N ATOM 186 CA GLU A 12 9.822 -11.050 -4.212 1.00 0.00 C ATOM 187 C GLU A 12 11.342 -11.014 -4.421 1.00 0.00 C ATOM 188 O GLU A 12 11.944 -11.962 -4.886 1.00 0.00 O ATOM 189 CB GLU A 12 9.095 -11.612 -5.436 1.00 0.00 C ATOM 190 CG GLU A 12 7.613 -11.826 -5.112 1.00 0.00 C ATOM 191 CD GLU A 12 6.956 -12.617 -6.246 1.00 0.00 C ATOM 192 OE1 GLU A 12 7.672 -13.038 -7.140 1.00 0.00 O ATOM 193 OE2 GLU A 12 5.749 -12.793 -6.199 1.00 0.00 O ATOM 0 H GLU A 12 9.223 -9.116 -4.891 1.00 0.00 H new ATOM 0 HA GLU A 12 9.638 -11.677 -3.340 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.197 -10.926 -6.277 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.550 -12.555 -5.738 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.509 -12.364 -4.170 1.00 0.00 H new ATOM 0 HG3 GLU A 12 7.114 -10.865 -4.987 1.00 0.00 H new ATOM 200 N SER A 13 11.960 -9.920 -4.056 1.00 0.00 N ATOM 201 CA SER A 13 13.442 -9.788 -4.196 1.00 0.00 C ATOM 202 C SER A 13 13.995 -9.030 -2.982 1.00 0.00 C ATOM 203 O SER A 13 13.658 -7.887 -2.752 1.00 0.00 O ATOM 204 CB SER A 13 13.659 -8.987 -5.477 1.00 0.00 C ATOM 205 OG SER A 13 14.936 -9.304 -6.015 1.00 0.00 O ATOM 0 H SER A 13 11.495 -9.102 -3.662 1.00 0.00 H new ATOM 0 HA SER A 13 13.949 -10.752 -4.243 1.00 0.00 H new ATOM 0 HB2 SER A 13 12.878 -9.218 -6.202 1.00 0.00 H new ATOM 0 HB3 SER A 13 13.594 -7.919 -5.268 1.00 0.00 H new ATOM 0 HG SER A 13 15.080 -8.793 -6.839 1.00 0.00 H new ATOM 211 N THR A 14 14.822 -9.656 -2.190 1.00 0.00 N ATOM 212 CA THR A 14 15.360 -8.965 -0.977 1.00 0.00 C ATOM 213 C THR A 14 15.878 -7.563 -1.310 1.00 0.00 C ATOM 214 O THR A 14 15.474 -6.590 -0.705 1.00 0.00 O ATOM 215 CB THR A 14 16.502 -9.849 -0.479 1.00 0.00 C ATOM 216 OG1 THR A 14 16.168 -11.214 -0.703 1.00 0.00 O ATOM 217 CG2 THR A 14 16.725 -9.607 1.019 1.00 0.00 C ATOM 0 H THR A 14 15.149 -10.612 -2.327 1.00 0.00 H new ATOM 0 HA THR A 14 14.582 -8.831 -0.225 1.00 0.00 H new ATOM 0 HB THR A 14 17.417 -9.605 -1.018 1.00 0.00 H new ATOM 0 HG1 THR A 14 16.644 -11.542 -1.495 1.00 0.00 H new ATOM 0 HG21 THR A 14 17.540 -10.239 1.372 1.00 0.00 H new ATOM 0 HG22 THR A 14 16.979 -8.560 1.185 1.00 0.00 H new ATOM 0 HG23 THR A 14 15.814 -9.850 1.566 1.00 0.00 H new ATOM 225 N ALA A 15 16.772 -7.440 -2.251 1.00 0.00 N ATOM 226 CA ALA A 15 17.301 -6.085 -2.578 1.00 0.00 C ATOM 227 C ALA A 15 16.151 -5.086 -2.705 1.00 0.00 C ATOM 228 O ALA A 15 16.131 -4.063 -2.049 1.00 0.00 O ATOM 229 CB ALA A 15 18.034 -6.244 -3.911 1.00 0.00 C ATOM 0 H ALA A 15 17.156 -8.208 -2.802 1.00 0.00 H new ATOM 0 HA ALA A 15 17.965 -5.705 -1.801 1.00 0.00 H new ATOM 0 HB1 ALA A 15 18.450 -5.283 -4.214 1.00 0.00 H new ATOM 0 HB2 ALA A 15 18.840 -6.970 -3.799 1.00 0.00 H new ATOM 0 HB3 ALA A 15 17.335 -6.593 -4.671 1.00 0.00 H new ATOM 235 N ILE A 16 15.183 -5.379 -3.529 1.00 0.00 N ATOM 236 CA ILE A 16 14.030 -4.445 -3.668 1.00 0.00 C ATOM 237 C ILE A 16 13.338 -4.302 -2.320 1.00 0.00 C ATOM 238 O ILE A 16 13.018 -3.212 -1.886 1.00 0.00 O ATOM 239 CB ILE A 16 13.093 -5.104 -4.683 1.00 0.00 C ATOM 240 CG1 ILE A 16 13.817 -5.246 -6.023 1.00 0.00 C ATOM 241 CG2 ILE A 16 11.846 -4.238 -4.859 1.00 0.00 C ATOM 242 CD1 ILE A 16 12.980 -6.110 -6.968 1.00 0.00 C ATOM 0 H ILE A 16 15.140 -6.218 -4.108 1.00 0.00 H new ATOM 0 HA ILE A 16 14.333 -3.450 -3.994 1.00 0.00 H new ATOM 0 HB ILE A 16 12.799 -6.091 -4.325 1.00 0.00 H new ATOM 0 HG12 ILE A 16 13.984 -4.263 -6.464 1.00 0.00 H new ATOM 0 HG13 ILE A 16 14.797 -5.698 -5.872 1.00 0.00 H new ATOM 0 HG21 ILE A 16 11.177 -4.706 -5.582 1.00 0.00 H new ATOM 0 HG22 ILE A 16 11.334 -4.139 -3.902 1.00 0.00 H new ATOM 0 HG23 ILE A 16 12.136 -3.251 -5.219 1.00 0.00 H new ATOM 0 HD11 ILE A 16 13.497 -6.211 -7.923 1.00 0.00 H new ATOM 0 HD12 ILE A 16 12.836 -7.097 -6.527 1.00 0.00 H new ATOM 0 HD13 ILE A 16 12.010 -5.639 -7.128 1.00 0.00 H new ATOM 254 N LEU A 17 13.119 -5.394 -1.646 1.00 0.00 N ATOM 255 CA LEU A 17 12.461 -5.323 -0.315 1.00 0.00 C ATOM 256 C LEU A 17 13.294 -4.446 0.622 1.00 0.00 C ATOM 257 O LEU A 17 12.776 -3.585 1.305 1.00 0.00 O ATOM 258 CB LEU A 17 12.415 -6.780 0.173 1.00 0.00 C ATOM 259 CG LEU A 17 12.366 -6.843 1.705 1.00 0.00 C ATOM 260 CD1 LEU A 17 13.777 -6.648 2.260 1.00 0.00 C ATOM 261 CD2 LEU A 17 11.435 -5.753 2.249 1.00 0.00 C ATOM 0 H LEU A 17 13.367 -6.332 -1.959 1.00 0.00 H new ATOM 0 HA LEU A 17 11.464 -4.883 -0.351 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.541 -7.280 -0.244 1.00 0.00 H new ATOM 0 HB3 LEU A 17 13.292 -7.317 -0.189 1.00 0.00 H new ATOM 0 HG LEU A 17 11.982 -7.815 2.015 1.00 0.00 H new ATOM 0 HD11 LEU A 17 13.749 -6.692 3.349 1.00 0.00 H new ATOM 0 HD12 LEU A 17 14.429 -7.436 1.882 1.00 0.00 H new ATOM 0 HD13 LEU A 17 14.161 -5.677 1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 17 11.408 -5.807 3.337 1.00 0.00 H new ATOM 0 HD22 LEU A 17 11.804 -4.774 1.944 1.00 0.00 H new ATOM 0 HD23 LEU A 17 10.430 -5.902 1.853 1.00 0.00 H new ATOM 273 N GLN A 18 14.581 -4.661 0.664 1.00 0.00 N ATOM 274 CA GLN A 18 15.434 -3.838 1.567 1.00 0.00 C ATOM 275 C GLN A 18 15.383 -2.366 1.170 1.00 0.00 C ATOM 276 O GLN A 18 15.238 -1.501 2.008 1.00 0.00 O ATOM 277 CB GLN A 18 16.855 -4.382 1.398 1.00 0.00 C ATOM 278 CG GLN A 18 16.980 -5.742 2.085 1.00 0.00 C ATOM 279 CD GLN A 18 18.427 -6.228 1.990 1.00 0.00 C ATOM 280 OE1 GLN A 18 18.965 -6.369 0.910 1.00 0.00 O ATOM 281 NE2 GLN A 18 19.086 -6.493 3.086 1.00 0.00 N ATOM 0 H GLN A 18 15.075 -5.365 0.116 1.00 0.00 H new ATOM 0 HA GLN A 18 15.093 -3.899 2.600 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.093 -4.477 0.339 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.574 -3.683 1.824 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.679 -5.663 3.130 1.00 0.00 H new ATOM 0 HG3 GLN A 18 16.311 -6.462 1.614 1.00 0.00 H new ATOM 0 HE21 GLN A 18 18.635 -6.375 3.993 1.00 0.00 H new ATOM 0 HE22 GLN A 18 20.051 -6.818 3.035 1.00 0.00 H new ATOM 290 N ASP A 19 15.510 -2.066 -0.096 1.00 0.00 N ATOM 291 CA ASP A 19 15.483 -0.635 -0.521 1.00 0.00 C ATOM 292 C ASP A 19 14.140 0.017 -0.164 1.00 0.00 C ATOM 293 O ASP A 19 14.099 1.125 0.342 1.00 0.00 O ATOM 294 CB ASP A 19 15.707 -0.670 -2.033 1.00 0.00 C ATOM 295 CG ASP A 19 17.147 -1.098 -2.314 1.00 0.00 C ATOM 296 OD1 ASP A 19 17.917 -1.171 -1.369 1.00 0.00 O ATOM 297 OD2 ASP A 19 17.458 -1.348 -3.467 1.00 0.00 O ATOM 0 H ASP A 19 15.630 -2.744 -0.849 1.00 0.00 H new ATOM 0 HA ASP A 19 16.243 -0.039 -0.016 1.00 0.00 H new ATOM 0 HB2 ASP A 19 15.010 -1.365 -2.501 1.00 0.00 H new ATOM 0 HB3 ASP A 19 15.515 0.312 -2.465 1.00 0.00 H new ATOM 302 N CYS A 20 13.043 -0.657 -0.400 1.00 0.00 N ATOM 303 CA CYS A 20 11.719 -0.060 -0.047 1.00 0.00 C ATOM 304 C CYS A 20 11.658 0.215 1.453 1.00 0.00 C ATOM 305 O CYS A 20 11.139 1.224 1.890 1.00 0.00 O ATOM 306 CB CYS A 20 10.675 -1.109 -0.437 1.00 0.00 C ATOM 307 SG CYS A 20 10.423 -1.073 -2.230 1.00 0.00 S ATOM 0 H CYS A 20 13.006 -1.587 -0.818 1.00 0.00 H new ATOM 0 HA CYS A 20 11.548 0.886 -0.561 1.00 0.00 H new ATOM 0 HB2 CYS A 20 11.006 -2.100 -0.125 1.00 0.00 H new ATOM 0 HB3 CYS A 20 9.735 -0.910 0.077 1.00 0.00 H new ATOM 0 HG CYS A 20 9.538 -1.966 -2.562 1.00 0.00 H new ATOM 313 N GLN A 21 12.188 -0.676 2.248 1.00 0.00 N ATOM 314 CA GLN A 21 12.165 -0.464 3.716 1.00 0.00 C ATOM 315 C GLN A 21 13.360 0.395 4.128 1.00 0.00 C ATOM 316 O GLN A 21 13.305 1.127 5.095 1.00 0.00 O ATOM 317 CB GLN A 21 12.244 -1.868 4.306 1.00 0.00 C ATOM 318 CG GLN A 21 11.066 -2.685 3.771 1.00 0.00 C ATOM 319 CD GLN A 21 10.907 -3.972 4.580 1.00 0.00 C ATOM 320 OE1 GLN A 21 9.835 -4.540 4.630 1.00 0.00 O ATOM 321 NE2 GLN A 21 11.933 -4.467 5.212 1.00 0.00 N ATOM 0 H GLN A 21 12.635 -1.540 1.940 1.00 0.00 H new ATOM 0 HA GLN A 21 11.276 0.061 4.065 1.00 0.00 H new ATOM 0 HB2 GLN A 21 13.188 -2.341 4.034 1.00 0.00 H new ATOM 0 HB3 GLN A 21 12.211 -1.824 5.395 1.00 0.00 H new ATOM 0 HG2 GLN A 21 10.150 -2.096 3.827 1.00 0.00 H new ATOM 0 HG3 GLN A 21 11.228 -2.925 2.720 1.00 0.00 H new ATOM 0 HE21 GLN A 21 12.835 -3.992 5.172 1.00 0.00 H new ATOM 0 HE22 GLN A 21 11.835 -5.330 5.747 1.00 0.00 H new ATOM 330 N ARG A 22 14.441 0.326 3.394 1.00 0.00 N ATOM 331 CA ARG A 22 15.621 1.160 3.755 1.00 0.00 C ATOM 332 C ARG A 22 15.166 2.594 3.941 1.00 0.00 C ATOM 333 O ARG A 22 15.426 3.222 4.947 1.00 0.00 O ATOM 334 CB ARG A 22 16.573 1.071 2.564 1.00 0.00 C ATOM 335 CG ARG A 22 17.995 1.316 3.051 1.00 0.00 C ATOM 336 CD ARG A 22 18.409 0.142 3.929 1.00 0.00 C ATOM 337 NE ARG A 22 19.744 0.514 4.469 1.00 0.00 N ATOM 338 CZ ARG A 22 20.806 0.434 3.712 1.00 0.00 C ATOM 339 NH1 ARG A 22 20.699 0.031 2.474 1.00 0.00 N ATOM 340 NH2 ARG A 22 21.973 0.755 4.195 1.00 0.00 N ATOM 0 H ARG A 22 14.555 -0.265 2.570 1.00 0.00 H new ATOM 0 HA ARG A 22 16.101 0.825 4.675 1.00 0.00 H new ATOM 0 HB2 ARG A 22 16.499 0.090 2.094 1.00 0.00 H new ATOM 0 HB3 ARG A 22 16.301 1.808 1.808 1.00 0.00 H new ATOM 0 HG2 ARG A 22 18.674 1.415 2.204 1.00 0.00 H new ATOM 0 HG3 ARG A 22 18.048 2.248 3.613 1.00 0.00 H new ATOM 0 HD2 ARG A 22 17.691 -0.022 4.732 1.00 0.00 H new ATOM 0 HD3 ARG A 22 18.460 -0.782 3.353 1.00 0.00 H new ATOM 0 HE ARG A 22 19.831 0.833 5.434 1.00 0.00 H new ATOM 0 HH11 ARG A 22 19.786 -0.222 2.097 1.00 0.00 H new ATOM 0 HH12 ARG A 22 21.529 -0.031 1.884 1.00 0.00 H new ATOM 0 HH21 ARG A 22 22.056 1.068 5.162 1.00 0.00 H new ATOM 0 HH22 ARG A 22 22.803 0.693 3.606 1.00 0.00 H new ATOM 354 N ALA A 23 14.469 3.109 2.977 1.00 0.00 N ATOM 355 CA ALA A 23 13.971 4.499 3.097 1.00 0.00 C ATOM 356 C ALA A 23 12.914 4.558 4.208 1.00 0.00 C ATOM 357 O ALA A 23 12.926 5.444 5.038 1.00 0.00 O ATOM 358 CB ALA A 23 13.368 4.833 1.735 1.00 0.00 C ATOM 0 H ALA A 23 14.222 2.629 2.112 1.00 0.00 H new ATOM 0 HA ALA A 23 14.753 5.212 3.358 1.00 0.00 H new ATOM 0 HB1 ALA A 23 12.978 5.851 1.750 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.137 4.750 0.967 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.558 4.137 1.515 1.00 0.00 H new ATOM 364 N LEU A 24 12.008 3.609 4.242 1.00 0.00 N ATOM 365 CA LEU A 24 10.972 3.605 5.313 1.00 0.00 C ATOM 366 C LEU A 24 11.546 2.995 6.586 1.00 0.00 C ATOM 367 O LEU A 24 11.013 2.052 7.132 1.00 0.00 O ATOM 368 CB LEU A 24 9.854 2.729 4.763 1.00 0.00 C ATOM 369 CG LEU A 24 9.388 3.319 3.445 1.00 0.00 C ATOM 370 CD1 LEU A 24 8.214 2.517 2.906 1.00 0.00 C ATOM 371 CD2 LEU A 24 8.962 4.760 3.686 1.00 0.00 C ATOM 0 H LEU A 24 11.945 2.841 3.574 1.00 0.00 H new ATOM 0 HA LEU A 24 10.624 4.607 5.565 1.00 0.00 H new ATOM 0 HB2 LEU A 24 10.208 1.709 4.618 1.00 0.00 H new ATOM 0 HB3 LEU A 24 9.026 2.681 5.471 1.00 0.00 H new ATOM 0 HG LEU A 24 10.197 3.286 2.715 1.00 0.00 H new ATOM 0 HD11 LEU A 24 7.884 2.946 1.960 1.00 0.00 H new ATOM 0 HD12 LEU A 24 8.521 1.483 2.748 1.00 0.00 H new ATOM 0 HD13 LEU A 24 7.394 2.546 3.623 1.00 0.00 H new ATOM 0 HD21 LEU A 24 8.624 5.201 2.748 1.00 0.00 H new ATOM 0 HD22 LEU A 24 8.149 4.783 4.412 1.00 0.00 H new ATOM 0 HD23 LEU A 24 9.808 5.330 4.071 1.00 0.00 H new ATOM 383 N SER A 25 12.640 3.521 7.058 1.00 0.00 N ATOM 384 CA SER A 25 13.257 2.965 8.291 1.00 0.00 C ATOM 385 C SER A 25 13.049 3.917 9.472 1.00 0.00 C ATOM 386 O SER A 25 13.601 3.723 10.534 1.00 0.00 O ATOM 387 CB SER A 25 14.746 2.829 7.967 1.00 0.00 C ATOM 388 OG SER A 25 15.498 2.931 9.169 1.00 0.00 O ATOM 0 H SER A 25 13.133 4.312 6.643 1.00 0.00 H new ATOM 0 HA SER A 25 12.813 2.011 8.575 1.00 0.00 H new ATOM 0 HB2 SER A 25 14.939 1.871 7.484 1.00 0.00 H new ATOM 0 HB3 SER A 25 15.050 3.607 7.267 1.00 0.00 H new ATOM 0 HG SER A 25 14.918 2.740 9.935 1.00 0.00 H new ATOM 394 N ALA A 26 12.257 4.944 9.304 1.00 0.00 N ATOM 395 CA ALA A 26 12.034 5.880 10.438 1.00 0.00 C ATOM 396 C ALA A 26 11.763 5.075 11.710 1.00 0.00 C ATOM 397 O ALA A 26 11.125 4.041 11.678 1.00 0.00 O ATOM 398 CB ALA A 26 10.814 6.702 10.038 1.00 0.00 C ATOM 0 H ALA A 26 11.762 5.171 8.441 1.00 0.00 H new ATOM 0 HA ALA A 26 12.893 6.520 10.639 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.584 7.419 10.826 1.00 0.00 H new ATOM 0 HB2 ALA A 26 11.023 7.236 9.111 1.00 0.00 H new ATOM 0 HB3 ALA A 26 9.961 6.039 9.890 1.00 0.00 H new ATOM 404 N ASP A 27 12.260 5.529 12.825 1.00 0.00 N ATOM 405 CA ASP A 27 12.055 4.778 14.099 1.00 0.00 C ATOM 406 C ASP A 27 10.578 4.459 14.323 1.00 0.00 C ATOM 407 O ASP A 27 10.236 3.591 15.105 1.00 0.00 O ATOM 408 CB ASP A 27 12.565 5.708 15.200 1.00 0.00 C ATOM 409 CG ASP A 27 12.609 4.951 16.529 1.00 0.00 C ATOM 410 OD1 ASP A 27 12.282 3.774 16.532 1.00 0.00 O ATOM 411 OD2 ASP A 27 12.965 5.561 17.524 1.00 0.00 O ATOM 0 H ASP A 27 12.801 6.389 12.912 1.00 0.00 H new ATOM 0 HA ASP A 27 12.580 3.823 14.085 1.00 0.00 H new ATOM 0 HB2 ASP A 27 13.559 6.078 14.947 1.00 0.00 H new ATOM 0 HB3 ASP A 27 11.914 6.578 15.286 1.00 0.00 H new ATOM 416 N ARG A 28 9.696 5.154 13.667 1.00 0.00 N ATOM 417 CA ARG A 28 8.249 4.882 13.881 1.00 0.00 C ATOM 418 C ARG A 28 7.659 4.095 12.704 1.00 0.00 C ATOM 419 O ARG A 28 6.482 4.175 12.423 1.00 0.00 O ATOM 420 CB ARG A 28 7.615 6.271 14.004 1.00 0.00 C ATOM 421 CG ARG A 28 7.433 6.891 12.619 1.00 0.00 C ATOM 422 CD ARG A 28 6.783 8.269 12.760 1.00 0.00 C ATOM 423 NE ARG A 28 7.785 9.112 13.476 1.00 0.00 N ATOM 424 CZ ARG A 28 8.807 9.614 12.831 1.00 0.00 C ATOM 425 NH1 ARG A 28 8.999 9.320 11.573 1.00 0.00 N ATOM 426 NH2 ARG A 28 9.650 10.399 13.452 1.00 0.00 N ATOM 0 H ARG A 28 9.910 5.893 12.997 1.00 0.00 H new ATOM 0 HA ARG A 28 8.064 4.270 14.764 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.651 6.196 14.507 1.00 0.00 H new ATOM 0 HB3 ARG A 28 8.245 6.914 14.618 1.00 0.00 H new ATOM 0 HG2 ARG A 28 8.398 6.981 12.119 1.00 0.00 H new ATOM 0 HG3 ARG A 28 6.812 6.245 11.998 1.00 0.00 H new ATOM 0 HD2 ARG A 28 6.541 8.690 11.784 1.00 0.00 H new ATOM 0 HD3 ARG A 28 5.850 8.207 13.320 1.00 0.00 H new ATOM 0 HE ARG A 28 7.673 9.298 14.473 1.00 0.00 H new ATOM 0 HH11 ARG A 28 8.351 8.697 11.090 1.00 0.00 H new ATOM 0 HH12 ARG A 28 9.797 9.713 11.073 1.00 0.00 H new ATOM 0 HH21 ARG A 28 9.510 10.619 14.438 1.00 0.00 H new ATOM 0 HH22 ARG A 28 10.447 10.791 12.950 1.00 0.00 H new ATOM 440 N TYR A 29 8.467 3.328 12.018 1.00 0.00 N ATOM 441 CA TYR A 29 7.942 2.534 10.870 1.00 0.00 C ATOM 442 C TYR A 29 7.807 1.058 11.237 1.00 0.00 C ATOM 443 O TYR A 29 8.762 0.406 11.613 1.00 0.00 O ATOM 444 CB TYR A 29 8.960 2.710 9.745 1.00 0.00 C ATOM 445 CG TYR A 29 8.535 3.871 8.892 1.00 0.00 C ATOM 446 CD1 TYR A 29 8.491 5.152 9.441 1.00 0.00 C ATOM 447 CD2 TYR A 29 8.173 3.666 7.559 1.00 0.00 C ATOM 448 CE1 TYR A 29 8.089 6.234 8.659 1.00 0.00 C ATOM 449 CE2 TYR A 29 7.769 4.748 6.772 1.00 0.00 C ATOM 450 CZ TYR A 29 7.726 6.032 7.324 1.00 0.00 C ATOM 451 OH TYR A 29 7.332 7.102 6.550 1.00 0.00 O ATOM 0 H TYR A 29 9.464 3.218 12.203 1.00 0.00 H new ATOM 0 HA TYR A 29 6.949 2.875 10.578 1.00 0.00 H new ATOM 0 HB2 TYR A 29 9.953 2.887 10.158 1.00 0.00 H new ATOM 0 HB3 TYR A 29 9.022 1.802 9.145 1.00 0.00 H new ATOM 0 HD1 TYR A 29 8.769 5.306 10.473 1.00 0.00 H new ATOM 0 HD2 TYR A 29 8.205 2.673 7.137 1.00 0.00 H new ATOM 0 HE1 TYR A 29 8.058 7.226 9.084 1.00 0.00 H new ATOM 0 HE2 TYR A 29 7.491 4.593 5.740 1.00 0.00 H new ATOM 0 HH TYR A 29 8.123 7.588 6.237 1.00 0.00 H new ATOM 461 N GLN A 30 6.630 0.526 11.101 1.00 0.00 N ATOM 462 CA GLN A 30 6.417 -0.919 11.409 1.00 0.00 C ATOM 463 C GLN A 30 6.069 -1.641 10.114 1.00 0.00 C ATOM 464 O GLN A 30 4.914 -1.837 9.795 1.00 0.00 O ATOM 465 CB GLN A 30 5.236 -0.952 12.382 1.00 0.00 C ATOM 466 CG GLN A 30 5.025 -2.383 12.895 1.00 0.00 C ATOM 467 CD GLN A 30 3.899 -2.395 13.929 1.00 0.00 C ATOM 468 OE1 GLN A 30 4.149 -2.441 15.120 1.00 0.00 O ATOM 469 NE2 GLN A 30 2.661 -2.356 13.525 1.00 0.00 N ATOM 0 H GLN A 30 5.799 1.028 10.788 1.00 0.00 H new ATOM 0 HA GLN A 30 7.294 -1.402 11.840 1.00 0.00 H new ATOM 0 HB2 GLN A 30 5.424 -0.280 13.219 1.00 0.00 H new ATOM 0 HB3 GLN A 30 4.333 -0.597 11.885 1.00 0.00 H new ATOM 0 HG2 GLN A 30 4.778 -3.045 12.065 1.00 0.00 H new ATOM 0 HG3 GLN A 30 5.946 -2.760 13.340 1.00 0.00 H new ATOM 0 HE21 GLN A 30 2.451 -2.317 12.528 1.00 0.00 H new ATOM 0 HE22 GLN A 30 1.902 -2.364 14.206 1.00 0.00 H new ATOM 478 N LEU A 31 7.054 -1.995 9.340 1.00 0.00 N ATOM 479 CA LEU A 31 6.762 -2.650 8.044 1.00 0.00 C ATOM 480 C LEU A 31 6.627 -4.167 8.173 1.00 0.00 C ATOM 481 O LEU A 31 7.434 -4.829 8.795 1.00 0.00 O ATOM 482 CB LEU A 31 7.955 -2.314 7.159 1.00 0.00 C ATOM 483 CG LEU A 31 8.209 -0.810 7.195 1.00 0.00 C ATOM 484 CD1 LEU A 31 9.486 -0.536 7.987 1.00 0.00 C ATOM 485 CD2 LEU A 31 8.367 -0.290 5.763 1.00 0.00 C ATOM 0 H LEU A 31 8.043 -1.859 9.550 1.00 0.00 H new ATOM 0 HA LEU A 31 5.812 -2.299 7.641 1.00 0.00 H new ATOM 0 HB2 LEU A 31 8.839 -2.851 7.503 1.00 0.00 H new ATOM 0 HB3 LEU A 31 7.764 -2.637 6.136 1.00 0.00 H new ATOM 0 HG LEU A 31 7.370 -0.303 7.673 1.00 0.00 H new ATOM 0 HD11 LEU A 31 9.673 0.537 8.016 1.00 0.00 H new ATOM 0 HD12 LEU A 31 9.371 -0.912 9.004 1.00 0.00 H new ATOM 0 HD13 LEU A 31 10.326 -1.038 7.507 1.00 0.00 H new ATOM 0 HD21 LEU A 31 8.549 0.785 5.784 1.00 0.00 H new ATOM 0 HD22 LEU A 31 9.209 -0.791 5.285 1.00 0.00 H new ATOM 0 HD23 LEU A 31 7.456 -0.493 5.200 1.00 0.00 H new ATOM 497 N GLN A 32 5.634 -4.723 7.535 1.00 0.00 N ATOM 498 CA GLN A 32 5.460 -6.199 7.548 1.00 0.00 C ATOM 499 C GLN A 32 5.786 -6.710 6.144 1.00 0.00 C ATOM 500 O GLN A 32 5.280 -6.205 5.163 1.00 0.00 O ATOM 501 CB GLN A 32 3.990 -6.446 7.902 1.00 0.00 C ATOM 502 CG GLN A 32 3.695 -7.948 7.850 1.00 0.00 C ATOM 503 CD GLN A 32 4.445 -8.663 8.978 1.00 0.00 C ATOM 504 OE1 GLN A 32 4.520 -8.166 10.084 1.00 0.00 O ATOM 505 NE2 GLN A 32 5.001 -9.818 8.741 1.00 0.00 N ATOM 0 H GLN A 32 4.931 -4.212 7.001 1.00 0.00 H new ATOM 0 HA GLN A 32 6.106 -6.710 8.262 1.00 0.00 H new ATOM 0 HB2 GLN A 32 3.775 -6.057 8.897 1.00 0.00 H new ATOM 0 HB3 GLN A 32 3.343 -5.914 7.205 1.00 0.00 H new ATOM 0 HG2 GLN A 32 2.623 -8.121 7.947 1.00 0.00 H new ATOM 0 HG3 GLN A 32 3.998 -8.354 6.885 1.00 0.00 H new ATOM 0 HE21 GLN A 32 4.937 -10.234 7.812 1.00 0.00 H new ATOM 0 HE22 GLN A 32 5.500 -10.306 9.485 1.00 0.00 H new ATOM 514 N VAL A 33 6.653 -7.672 6.030 1.00 0.00 N ATOM 515 CA VAL A 33 7.030 -8.161 4.675 1.00 0.00 C ATOM 516 C VAL A 33 6.135 -9.319 4.230 1.00 0.00 C ATOM 517 O VAL A 33 5.912 -10.265 4.961 1.00 0.00 O ATOM 518 CB VAL A 33 8.474 -8.633 4.820 1.00 0.00 C ATOM 519 CG1 VAL A 33 8.985 -9.119 3.465 1.00 0.00 C ATOM 520 CG2 VAL A 33 9.348 -7.473 5.310 1.00 0.00 C ATOM 0 H VAL A 33 7.116 -8.140 6.809 1.00 0.00 H new ATOM 0 HA VAL A 33 6.916 -7.382 3.921 1.00 0.00 H new ATOM 0 HB VAL A 33 8.519 -9.448 5.542 1.00 0.00 H new ATOM 0 HG11 VAL A 33 10.016 -9.457 3.565 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.365 -9.945 3.117 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.939 -8.302 2.745 1.00 0.00 H new ATOM 0 HG21 VAL A 33 10.379 -7.812 5.413 1.00 0.00 H new ATOM 0 HG22 VAL A 33 9.305 -6.656 4.590 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.982 -7.125 6.276 1.00 0.00 H new ATOM 530 N CYS A 34 5.627 -9.250 3.028 1.00 0.00 N ATOM 531 CA CYS A 34 4.752 -10.349 2.518 1.00 0.00 C ATOM 532 C CYS A 34 5.501 -11.167 1.460 1.00 0.00 C ATOM 533 O CYS A 34 5.744 -10.709 0.358 1.00 0.00 O ATOM 534 CB CYS A 34 3.540 -9.652 1.898 1.00 0.00 C ATOM 535 SG CYS A 34 2.666 -8.703 3.167 1.00 0.00 S ATOM 0 H CYS A 34 5.780 -8.480 2.376 1.00 0.00 H new ATOM 0 HA CYS A 34 4.457 -11.038 3.309 1.00 0.00 H new ATOM 0 HB2 CYS A 34 3.861 -8.991 1.093 1.00 0.00 H new ATOM 0 HB3 CYS A 34 2.870 -10.390 1.457 1.00 0.00 H new ATOM 0 HG CYS A 34 2.341 -7.538 2.691 1.00 0.00 H new ATOM 541 N GLU A 35 5.871 -12.372 1.791 1.00 0.00 N ATOM 542 CA GLU A 35 6.611 -13.232 0.822 1.00 0.00 C ATOM 543 C GLU A 35 5.777 -13.478 -0.439 1.00 0.00 C ATOM 544 O GLU A 35 6.309 -13.661 -1.517 1.00 0.00 O ATOM 545 CB GLU A 35 6.849 -14.543 1.574 1.00 0.00 C ATOM 546 CG GLU A 35 7.769 -14.280 2.770 1.00 0.00 C ATOM 547 CD GLU A 35 8.001 -15.584 3.536 1.00 0.00 C ATOM 548 OE1 GLU A 35 7.398 -16.579 3.171 1.00 0.00 O ATOM 549 OE2 GLU A 35 8.777 -15.563 4.476 1.00 0.00 O ATOM 0 H GLU A 35 5.692 -12.803 2.698 1.00 0.00 H new ATOM 0 HA GLU A 35 7.540 -12.769 0.489 1.00 0.00 H new ATOM 0 HB2 GLU A 35 5.900 -14.958 1.915 1.00 0.00 H new ATOM 0 HB3 GLU A 35 7.299 -15.280 0.909 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.721 -13.874 2.427 1.00 0.00 H new ATOM 0 HG3 GLU A 35 7.323 -13.534 3.428 1.00 0.00 H new ATOM 556 N SER A 36 4.478 -13.494 -0.320 1.00 0.00 N ATOM 557 CA SER A 36 3.637 -13.742 -1.526 1.00 0.00 C ATOM 558 C SER A 36 2.618 -12.617 -1.712 1.00 0.00 C ATOM 559 O SER A 36 2.660 -11.604 -1.042 1.00 0.00 O ATOM 560 CB SER A 36 2.919 -15.064 -1.254 1.00 0.00 C ATOM 561 OG SER A 36 3.462 -15.668 -0.088 1.00 0.00 O ATOM 0 H SER A 36 3.966 -13.348 0.550 1.00 0.00 H new ATOM 0 HA SER A 36 4.238 -13.781 -2.435 1.00 0.00 H new ATOM 0 HB2 SER A 36 1.851 -14.890 -1.122 1.00 0.00 H new ATOM 0 HB3 SER A 36 3.030 -15.732 -2.108 1.00 0.00 H new ATOM 0 HG SER A 36 3.080 -16.564 0.024 1.00 0.00 H new ATOM 567 N GLY A 37 1.687 -12.802 -2.608 1.00 0.00 N ATOM 568 CA GLY A 37 0.647 -11.764 -2.833 1.00 0.00 C ATOM 569 C GLY A 37 -0.614 -12.223 -2.119 1.00 0.00 C ATOM 570 O GLY A 37 -1.449 -11.438 -1.718 1.00 0.00 O ATOM 0 H GLY A 37 1.604 -13.632 -3.195 1.00 0.00 H new ATOM 0 HA2 GLY A 37 0.977 -10.800 -2.447 1.00 0.00 H new ATOM 0 HA3 GLY A 37 0.459 -11.633 -3.899 1.00 0.00 H new ATOM 574 N GLU A 38 -0.720 -13.506 -1.922 1.00 0.00 N ATOM 575 CA GLU A 38 -1.878 -14.066 -1.190 1.00 0.00 C ATOM 576 C GLU A 38 -1.649 -13.800 0.290 1.00 0.00 C ATOM 577 O GLU A 38 -2.486 -13.268 0.994 1.00 0.00 O ATOM 578 CB GLU A 38 -1.818 -15.564 -1.481 1.00 0.00 C ATOM 579 CG GLU A 38 -2.632 -15.897 -2.730 1.00 0.00 C ATOM 580 CD GLU A 38 -2.817 -17.414 -2.819 1.00 0.00 C ATOM 581 OE1 GLU A 38 -2.011 -18.122 -2.234 1.00 0.00 O ATOM 582 OE2 GLU A 38 -3.756 -17.841 -3.467 1.00 0.00 O ATOM 0 H GLU A 38 -0.042 -14.197 -2.243 1.00 0.00 H new ATOM 0 HA GLU A 38 -2.841 -13.642 -1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -0.782 -15.872 -1.621 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -2.204 -16.122 -0.628 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -3.602 -15.402 -2.689 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.123 -15.528 -3.620 1.00 0.00 H new ATOM 589 N MET A 39 -0.484 -14.157 0.750 1.00 0.00 N ATOM 590 CA MET A 39 -0.129 -13.929 2.169 1.00 0.00 C ATOM 591 C MET A 39 -0.345 -12.453 2.519 1.00 0.00 C ATOM 592 O MET A 39 -0.755 -12.115 3.611 1.00 0.00 O ATOM 593 CB MET A 39 1.350 -14.313 2.241 1.00 0.00 C ATOM 594 CG MET A 39 1.480 -15.836 2.156 1.00 0.00 C ATOM 595 SD MET A 39 0.856 -16.573 3.684 1.00 0.00 S ATOM 596 CE MET A 39 1.957 -15.690 4.819 1.00 0.00 C ATOM 0 H MET A 39 0.244 -14.603 0.192 1.00 0.00 H new ATOM 0 HA MET A 39 -0.732 -14.504 2.872 1.00 0.00 H new ATOM 0 HB2 MET A 39 1.900 -13.843 1.426 1.00 0.00 H new ATOM 0 HB3 MET A 39 1.787 -13.950 3.171 1.00 0.00 H new ATOM 0 HG2 MET A 39 0.919 -16.213 1.301 1.00 0.00 H new ATOM 0 HG3 MET A 39 2.522 -16.116 2.003 1.00 0.00 H new ATOM 0 HE1 MET A 39 2.191 -16.330 5.670 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.878 -15.425 4.300 1.00 0.00 H new ATOM 0 HE3 MET A 39 1.465 -14.783 5.171 1.00 0.00 H new ATOM 606 N LEU A 40 -0.090 -11.574 1.588 1.00 0.00 N ATOM 607 CA LEU A 40 -0.302 -10.123 1.852 1.00 0.00 C ATOM 608 C LEU A 40 -1.779 -9.873 2.154 1.00 0.00 C ATOM 609 O LEU A 40 -2.127 -9.124 3.046 1.00 0.00 O ATOM 610 CB LEU A 40 0.119 -9.427 0.552 1.00 0.00 C ATOM 611 CG LEU A 40 -0.592 -8.074 0.404 1.00 0.00 C ATOM 612 CD1 LEU A 40 -0.640 -7.346 1.750 1.00 0.00 C ATOM 613 CD2 LEU A 40 0.168 -7.211 -0.604 1.00 0.00 C ATOM 0 H LEU A 40 0.256 -11.799 0.655 1.00 0.00 H new ATOM 0 HA LEU A 40 0.266 -9.755 2.707 1.00 0.00 H new ATOM 0 HB2 LEU A 40 1.199 -9.278 0.547 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.119 -10.063 -0.300 1.00 0.00 H new ATOM 0 HG LEU A 40 -1.611 -8.248 0.057 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.147 -6.389 1.628 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.183 -7.954 2.474 1.00 0.00 H new ATOM 0 HD13 LEU A 40 0.375 -7.176 2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -0.334 -6.250 -0.711 1.00 0.00 H new ATOM 0 HD22 LEU A 40 1.187 -7.051 -0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 40 0.194 -7.717 -1.569 1.00 0.00 H new ATOM 625 N LEU A 41 -2.651 -10.502 1.418 1.00 0.00 N ATOM 626 CA LEU A 41 -4.105 -10.312 1.657 1.00 0.00 C ATOM 627 C LEU A 41 -4.454 -10.727 3.083 1.00 0.00 C ATOM 628 O LEU A 41 -5.246 -10.094 3.750 1.00 0.00 O ATOM 629 CB LEU A 41 -4.786 -11.234 0.644 1.00 0.00 C ATOM 630 CG LEU A 41 -4.393 -10.816 -0.773 1.00 0.00 C ATOM 631 CD1 LEU A 41 -4.987 -11.799 -1.784 1.00 0.00 C ATOM 632 CD2 LEU A 41 -4.933 -9.414 -1.048 1.00 0.00 C ATOM 0 H LEU A 41 -2.417 -11.142 0.659 1.00 0.00 H new ATOM 0 HA LEU A 41 -4.420 -9.275 1.542 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -4.493 -12.268 0.824 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.868 -11.184 0.762 1.00 0.00 H new ATOM 0 HG LEU A 41 -3.307 -10.818 -0.867 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -4.705 -11.498 -2.793 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -4.606 -12.801 -1.584 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -6.073 -11.799 -1.696 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -4.656 -9.109 -2.057 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -6.019 -9.418 -0.955 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.509 -8.713 -0.328 1.00 0.00 H new ATOM 644 N GLU A 42 -3.869 -11.791 3.556 1.00 0.00 N ATOM 645 CA GLU A 42 -4.170 -12.241 4.942 1.00 0.00 C ATOM 646 C GLU A 42 -3.797 -11.151 5.953 1.00 0.00 C ATOM 647 O GLU A 42 -4.564 -10.830 6.839 1.00 0.00 O ATOM 648 CB GLU A 42 -3.313 -13.488 5.154 1.00 0.00 C ATOM 649 CG GLU A 42 -3.817 -14.249 6.380 1.00 0.00 C ATOM 650 CD GLU A 42 -2.712 -15.174 6.890 1.00 0.00 C ATOM 651 OE1 GLU A 42 -1.747 -15.364 6.171 1.00 0.00 O ATOM 652 OE2 GLU A 42 -2.851 -15.674 7.994 1.00 0.00 O ATOM 0 H GLU A 42 -3.199 -12.366 3.046 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.231 -12.449 5.082 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.357 -14.127 4.272 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.269 -13.206 5.291 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -4.110 -13.548 7.162 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -4.703 -14.829 6.123 1.00 0.00 H new ATOM 659 N TYR A 43 -2.627 -10.581 5.835 1.00 0.00 N ATOM 660 CA TYR A 43 -2.226 -9.515 6.802 1.00 0.00 C ATOM 661 C TYR A 43 -3.108 -8.278 6.636 1.00 0.00 C ATOM 662 O TYR A 43 -3.554 -7.688 7.600 1.00 0.00 O ATOM 663 CB TYR A 43 -0.776 -9.174 6.453 1.00 0.00 C ATOM 664 CG TYR A 43 -0.356 -7.928 7.199 1.00 0.00 C ATOM 665 CD1 TYR A 43 -0.626 -7.805 8.568 1.00 0.00 C ATOM 666 CD2 TYR A 43 0.299 -6.893 6.522 1.00 0.00 C ATOM 667 CE1 TYR A 43 -0.240 -6.653 9.259 1.00 0.00 C ATOM 668 CE2 TYR A 43 0.685 -5.737 7.212 1.00 0.00 C ATOM 669 CZ TYR A 43 0.416 -5.618 8.583 1.00 0.00 C ATOM 670 OH TYR A 43 0.797 -4.480 9.266 1.00 0.00 O ATOM 0 H TYR A 43 -1.937 -10.804 5.118 1.00 0.00 H new ATOM 0 HA TYR A 43 -2.333 -9.849 7.834 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -0.122 -10.006 6.716 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -0.677 -9.018 5.379 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -1.134 -8.602 9.091 1.00 0.00 H new ATOM 0 HD2 TYR A 43 0.507 -6.986 5.466 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.448 -6.562 10.315 1.00 0.00 H new ATOM 0 HE2 TYR A 43 1.189 -4.938 6.689 1.00 0.00 H new ATOM 0 HH TYR A 43 1.154 -3.823 8.633 1.00 0.00 H new ATOM 680 N ALA A 44 -3.353 -7.866 5.422 1.00 0.00 N ATOM 681 CA ALA A 44 -4.188 -6.654 5.208 1.00 0.00 C ATOM 682 C ALA A 44 -5.678 -6.974 5.359 1.00 0.00 C ATOM 683 O ALA A 44 -6.475 -6.100 5.616 1.00 0.00 O ATOM 684 CB ALA A 44 -3.876 -6.210 3.782 1.00 0.00 C ATOM 0 H ALA A 44 -3.011 -8.316 4.573 1.00 0.00 H new ATOM 0 HA ALA A 44 -3.969 -5.878 5.941 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -4.454 -5.317 3.544 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -2.813 -5.987 3.695 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -4.138 -7.008 3.087 1.00 0.00 H new ATOM 690 N GLN A 45 -6.066 -8.209 5.193 1.00 0.00 N ATOM 691 CA GLN A 45 -7.516 -8.552 5.322 1.00 0.00 C ATOM 692 C GLN A 45 -8.037 -8.275 6.727 1.00 0.00 C ATOM 693 O GLN A 45 -9.230 -8.165 6.941 1.00 0.00 O ATOM 694 CB GLN A 45 -7.596 -10.051 5.059 1.00 0.00 C ATOM 695 CG GLN A 45 -7.812 -10.298 3.576 1.00 0.00 C ATOM 696 CD GLN A 45 -7.460 -11.748 3.256 1.00 0.00 C ATOM 697 OE1 GLN A 45 -7.115 -12.507 4.139 1.00 0.00 O ATOM 698 NE2 GLN A 45 -7.539 -12.172 2.027 1.00 0.00 N ATOM 0 H GLN A 45 -5.449 -8.992 4.975 1.00 0.00 H new ATOM 0 HA GLN A 45 -8.114 -7.957 4.632 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.678 -10.538 5.389 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.413 -10.488 5.633 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.849 -10.095 3.308 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.192 -9.622 2.988 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -7.829 -11.535 1.285 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -7.311 -13.141 1.806 1.00 0.00 H new ATOM 707 N THR A 46 -7.175 -8.211 7.696 1.00 0.00 N ATOM 708 CA THR A 46 -7.668 -8.001 9.084 1.00 0.00 C ATOM 709 C THR A 46 -7.020 -6.773 9.725 1.00 0.00 C ATOM 710 O THR A 46 -7.414 -6.337 10.788 1.00 0.00 O ATOM 711 CB THR A 46 -7.276 -9.292 9.812 1.00 0.00 C ATOM 712 OG1 THR A 46 -5.894 -9.251 10.136 1.00 0.00 O ATOM 713 CG2 THR A 46 -7.554 -10.495 8.896 1.00 0.00 C ATOM 0 H THR A 46 -6.164 -8.293 7.593 1.00 0.00 H new ATOM 0 HA THR A 46 -8.740 -7.810 9.125 1.00 0.00 H new ATOM 0 HB THR A 46 -7.859 -9.388 10.728 1.00 0.00 H new ATOM 0 HG1 THR A 46 -5.643 -10.075 10.603 1.00 0.00 H new ATOM 0 HG21 THR A 46 -7.277 -11.415 9.410 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.615 -10.525 8.646 1.00 0.00 H new ATOM 0 HG23 THR A 46 -6.968 -10.399 7.982 1.00 0.00 H new ATOM 721 N HIS A 47 -6.045 -6.199 9.079 1.00 0.00 N ATOM 722 CA HIS A 47 -5.392 -4.985 9.643 1.00 0.00 C ATOM 723 C HIS A 47 -5.556 -3.810 8.679 1.00 0.00 C ATOM 724 O HIS A 47 -4.812 -2.852 8.729 1.00 0.00 O ATOM 725 CB HIS A 47 -3.919 -5.358 9.794 1.00 0.00 C ATOM 726 CG HIS A 47 -3.787 -6.406 10.856 1.00 0.00 C ATOM 727 ND1 HIS A 47 -4.318 -6.242 12.126 1.00 0.00 N ATOM 728 CD2 HIS A 47 -3.197 -7.642 10.852 1.00 0.00 C ATOM 729 CE1 HIS A 47 -4.040 -7.355 12.828 1.00 0.00 C ATOM 730 NE2 HIS A 47 -3.359 -8.242 12.098 1.00 0.00 N ATOM 0 H HIS A 47 -5.672 -6.518 8.185 1.00 0.00 H new ATOM 0 HA HIS A 47 -5.830 -4.681 10.594 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -3.526 -5.730 8.848 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -3.333 -4.478 10.059 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.684 -8.084 10.011 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -4.332 -7.512 13.856 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -3.028 -9.162 12.390 1.00 0.00 H new ATOM 738 N ARG A 48 -6.521 -3.890 7.794 1.00 0.00 N ATOM 739 CA ARG A 48 -6.728 -2.781 6.800 1.00 0.00 C ATOM 740 C ARG A 48 -6.517 -1.445 7.504 1.00 0.00 C ATOM 741 O ARG A 48 -5.707 -0.631 7.103 1.00 0.00 O ATOM 742 CB ARG A 48 -8.196 -2.852 6.315 1.00 0.00 C ATOM 743 CG ARG A 48 -8.754 -4.276 6.386 1.00 0.00 C ATOM 744 CD ARG A 48 -10.180 -4.302 5.832 1.00 0.00 C ATOM 745 NE ARG A 48 -11.025 -3.932 6.999 1.00 0.00 N ATOM 746 CZ ARG A 48 -12.327 -4.031 6.935 1.00 0.00 C ATOM 747 NH1 ARG A 48 -12.906 -4.437 5.840 1.00 0.00 N ATOM 748 NH2 ARG A 48 -13.049 -3.721 7.977 1.00 0.00 N ATOM 0 H ARG A 48 -7.173 -4.670 7.714 1.00 0.00 H new ATOM 0 HA ARG A 48 -6.034 -2.877 5.965 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -8.812 -2.190 6.924 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -8.257 -2.489 5.289 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -8.120 -4.954 5.815 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -8.748 -4.628 7.418 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -10.302 -3.596 5.011 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -10.441 -5.288 5.447 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.585 -3.598 7.856 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -12.343 -4.680 5.025 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -13.922 -4.512 5.798 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -12.597 -3.404 8.835 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -14.065 -3.796 7.934 1.00 0.00 H new ATOM 762 N ASP A 49 -7.238 -1.231 8.561 1.00 0.00 N ATOM 763 CA ASP A 49 -7.090 0.045 9.326 1.00 0.00 C ATOM 764 C ASP A 49 -5.700 0.128 9.958 1.00 0.00 C ATOM 765 O ASP A 49 -5.070 1.169 9.969 1.00 0.00 O ATOM 766 CB ASP A 49 -8.154 -0.021 10.421 1.00 0.00 C ATOM 767 CG ASP A 49 -8.574 1.398 10.808 1.00 0.00 C ATOM 768 OD1 ASP A 49 -7.834 2.035 11.542 1.00 0.00 O ATOM 769 OD2 ASP A 49 -9.630 1.823 10.364 1.00 0.00 O ATOM 0 H ASP A 49 -7.928 -1.883 8.935 1.00 0.00 H new ATOM 0 HA ASP A 49 -7.208 0.919 8.685 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -9.018 -0.585 10.070 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -7.763 -0.547 11.292 1.00 0.00 H new ATOM 774 N GLN A 50 -5.215 -0.960 10.493 1.00 0.00 N ATOM 775 CA GLN A 50 -3.869 -0.943 11.131 1.00 0.00 C ATOM 776 C GLN A 50 -2.781 -0.731 10.080 1.00 0.00 C ATOM 777 O GLN A 50 -1.713 -0.231 10.373 1.00 0.00 O ATOM 778 CB GLN A 50 -3.730 -2.312 11.796 1.00 0.00 C ATOM 779 CG GLN A 50 -4.788 -2.452 12.889 1.00 0.00 C ATOM 780 CD GLN A 50 -4.379 -3.554 13.867 1.00 0.00 C ATOM 781 OE1 GLN A 50 -3.208 -3.738 14.135 1.00 0.00 O ATOM 782 NE2 GLN A 50 -5.299 -4.295 14.418 1.00 0.00 N ATOM 0 H GLN A 50 -5.694 -1.860 10.515 1.00 0.00 H new ATOM 0 HA GLN A 50 -3.763 -0.131 11.851 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -3.849 -3.103 11.055 1.00 0.00 H new ATOM 0 HB3 GLN A 50 -2.733 -2.422 12.223 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -4.904 -1.507 13.419 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -5.755 -2.688 12.444 1.00 0.00 H new ATOM 0 HE21 GLN A 50 -6.282 -4.140 14.193 1.00 0.00 H new ATOM 0 HE22 GLN A 50 -5.036 -5.030 15.075 1.00 0.00 H new ATOM 791 N ILE A 51 -3.035 -1.102 8.855 1.00 0.00 N ATOM 792 CA ILE A 51 -1.999 -0.903 7.805 1.00 0.00 C ATOM 793 C ILE A 51 -1.930 0.582 7.441 1.00 0.00 C ATOM 794 O ILE A 51 -2.882 1.159 6.953 1.00 0.00 O ATOM 795 CB ILE A 51 -2.464 -1.743 6.609 1.00 0.00 C ATOM 796 CG1 ILE A 51 -2.644 -3.226 6.999 1.00 0.00 C ATOM 797 CG2 ILE A 51 -1.420 -1.648 5.498 1.00 0.00 C ATOM 798 CD1 ILE A 51 -1.884 -3.566 8.292 1.00 0.00 C ATOM 0 H ILE A 51 -3.905 -1.530 8.539 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.003 -1.204 8.131 1.00 0.00 H new ATOM 0 HB ILE A 51 -3.425 -1.356 6.272 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -3.704 -3.442 7.132 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -2.288 -3.862 6.189 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.743 -2.243 4.643 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -1.306 -0.608 5.194 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.465 -2.026 5.863 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -2.033 -4.618 8.536 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.820 -3.374 8.150 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -2.259 -2.948 9.108 1.00 0.00 H new ATOM 810 N ASP A 52 -0.820 1.217 7.704 1.00 0.00 N ATOM 811 CA ASP A 52 -0.707 2.672 7.404 1.00 0.00 C ATOM 812 C ASP A 52 -0.256 2.921 5.958 1.00 0.00 C ATOM 813 O ASP A 52 -0.564 3.946 5.384 1.00 0.00 O ATOM 814 CB ASP A 52 0.335 3.190 8.396 1.00 0.00 C ATOM 815 CG ASP A 52 -0.309 3.340 9.777 1.00 0.00 C ATOM 816 OD1 ASP A 52 -0.300 2.373 10.522 1.00 0.00 O ATOM 817 OD2 ASP A 52 -0.795 4.420 10.068 1.00 0.00 O ATOM 0 H ASP A 52 0.012 0.791 8.113 1.00 0.00 H new ATOM 0 HA ASP A 52 -1.667 3.179 7.502 1.00 0.00 H new ATOM 0 HB2 ASP A 52 1.178 2.501 8.448 1.00 0.00 H new ATOM 0 HB3 ASP A 52 0.728 4.149 8.060 1.00 0.00 H new ATOM 822 N CYS A 53 0.475 2.014 5.363 1.00 0.00 N ATOM 823 CA CYS A 53 0.932 2.242 3.955 1.00 0.00 C ATOM 824 C CYS A 53 1.374 0.915 3.312 1.00 0.00 C ATOM 825 O CYS A 53 2.126 0.163 3.898 1.00 0.00 O ATOM 826 CB CYS A 53 2.112 3.214 4.107 1.00 0.00 C ATOM 827 SG CYS A 53 2.205 4.297 2.659 1.00 0.00 S ATOM 0 H CYS A 53 0.774 1.134 5.783 1.00 0.00 H new ATOM 0 HA CYS A 53 0.150 2.640 3.308 1.00 0.00 H new ATOM 0 HB2 CYS A 53 1.990 3.810 5.011 1.00 0.00 H new ATOM 0 HB3 CYS A 53 3.042 2.657 4.216 1.00 0.00 H new ATOM 0 HG CYS A 53 1.489 3.797 1.696 1.00 0.00 H new ATOM 833 N LEU A 54 0.916 0.610 2.113 1.00 0.00 N ATOM 834 CA LEU A 54 1.336 -0.688 1.480 1.00 0.00 C ATOM 835 C LEU A 54 2.324 -0.446 0.334 1.00 0.00 C ATOM 836 O LEU A 54 2.161 0.452 -0.462 1.00 0.00 O ATOM 837 CB LEU A 54 0.047 -1.325 0.942 1.00 0.00 C ATOM 838 CG LEU A 54 0.374 -2.647 0.224 1.00 0.00 C ATOM 839 CD1 LEU A 54 0.358 -3.801 1.228 1.00 0.00 C ATOM 840 CD2 LEU A 54 -0.670 -2.918 -0.863 1.00 0.00 C ATOM 0 H LEU A 54 0.285 1.188 1.558 1.00 0.00 H new ATOM 0 HA LEU A 54 1.840 -1.332 2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -0.647 -1.509 1.762 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -0.447 -0.640 0.253 1.00 0.00 H new ATOM 0 HG LEU A 54 1.363 -2.568 -0.227 1.00 0.00 H new ATOM 0 HD11 LEU A 54 0.590 -4.734 0.714 1.00 0.00 H new ATOM 0 HD12 LEU A 54 1.102 -3.619 2.003 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -0.630 -3.874 1.683 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -0.434 -3.855 -1.368 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -1.658 -2.989 -0.409 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -0.662 -2.103 -1.587 1.00 0.00 H new ATOM 852 N ILE A 55 3.344 -1.253 0.232 1.00 0.00 N ATOM 853 CA ILE A 55 4.321 -1.062 -0.880 1.00 0.00 C ATOM 854 C ILE A 55 4.147 -2.178 -1.898 1.00 0.00 C ATOM 855 O ILE A 55 4.084 -3.341 -1.553 1.00 0.00 O ATOM 856 CB ILE A 55 5.699 -1.144 -0.235 1.00 0.00 C ATOM 857 CG1 ILE A 55 5.797 -0.108 0.876 1.00 0.00 C ATOM 858 CG2 ILE A 55 6.781 -0.871 -1.284 1.00 0.00 C ATOM 859 CD1 ILE A 55 6.925 -0.504 1.819 1.00 0.00 C ATOM 0 H ILE A 55 3.543 -2.029 0.863 1.00 0.00 H new ATOM 0 HA ILE A 55 4.181 -0.113 -1.397 1.00 0.00 H new ATOM 0 HB ILE A 55 5.845 -2.142 0.179 1.00 0.00 H new ATOM 0 HG12 ILE A 55 5.986 0.880 0.455 1.00 0.00 H new ATOM 0 HG13 ILE A 55 4.854 -0.048 1.420 1.00 0.00 H new ATOM 0 HG21 ILE A 55 7.764 -0.931 -0.817 1.00 0.00 H new ATOM 0 HG22 ILE A 55 6.712 -1.613 -2.080 1.00 0.00 H new ATOM 0 HG23 ILE A 55 6.639 0.125 -1.703 1.00 0.00 H new ATOM 0 HD11 ILE A 55 7.005 0.231 2.620 1.00 0.00 H new ATOM 0 HD12 ILE A 55 6.715 -1.484 2.246 1.00 0.00 H new ATOM 0 HD13 ILE A 55 7.864 -0.543 1.267 1.00 0.00 H new ATOM 871 N LEU A 56 4.054 -1.841 -3.148 1.00 0.00 N ATOM 872 CA LEU A 56 3.867 -2.898 -4.170 1.00 0.00 C ATOM 873 C LEU A 56 4.856 -2.746 -5.317 1.00 0.00 C ATOM 874 O LEU A 56 5.320 -1.668 -5.630 1.00 0.00 O ATOM 875 CB LEU A 56 2.444 -2.707 -4.675 1.00 0.00 C ATOM 876 CG LEU A 56 1.465 -3.063 -3.562 1.00 0.00 C ATOM 877 CD1 LEU A 56 0.038 -2.908 -4.078 1.00 0.00 C ATOM 878 CD2 LEU A 56 1.695 -4.513 -3.131 1.00 0.00 C ATOM 0 H LEU A 56 4.099 -0.886 -3.505 1.00 0.00 H new ATOM 0 HA LEU A 56 4.035 -3.890 -3.752 1.00 0.00 H new ATOM 0 HB2 LEU A 56 2.293 -1.675 -4.992 1.00 0.00 H new ATOM 0 HB3 LEU A 56 2.267 -3.337 -5.547 1.00 0.00 H new ATOM 0 HG LEU A 56 1.620 -2.400 -2.711 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -0.665 -3.162 -3.285 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -0.125 -1.877 -4.392 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -0.116 -3.574 -4.927 1.00 0.00 H new ATOM 0 HD21 LEU A 56 0.997 -4.771 -2.335 1.00 0.00 H new ATOM 0 HD22 LEU A 56 1.536 -5.175 -3.982 1.00 0.00 H new ATOM 0 HD23 LEU A 56 2.717 -4.627 -2.768 1.00 0.00 H new ATOM 890 N VAL A 57 5.149 -3.834 -5.959 1.00 0.00 N ATOM 891 CA VAL A 57 6.075 -3.803 -7.115 1.00 0.00 C ATOM 892 C VAL A 57 5.304 -4.272 -8.348 1.00 0.00 C ATOM 893 O VAL A 57 4.935 -5.424 -8.448 1.00 0.00 O ATOM 894 CB VAL A 57 7.181 -4.801 -6.764 1.00 0.00 C ATOM 895 CG1 VAL A 57 8.051 -5.050 -7.997 1.00 0.00 C ATOM 896 CG2 VAL A 57 8.043 -4.236 -5.630 1.00 0.00 C ATOM 0 H VAL A 57 4.781 -4.757 -5.729 1.00 0.00 H new ATOM 0 HA VAL A 57 6.486 -2.814 -7.320 1.00 0.00 H new ATOM 0 HB VAL A 57 6.733 -5.741 -6.440 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.839 -5.761 -7.749 1.00 0.00 H new ATOM 0 HG12 VAL A 57 7.436 -5.456 -8.800 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.499 -4.111 -8.322 1.00 0.00 H new ATOM 0 HG21 VAL A 57 8.830 -4.948 -5.382 1.00 0.00 H new ATOM 0 HG22 VAL A 57 8.492 -3.295 -5.948 1.00 0.00 H new ATOM 0 HG23 VAL A 57 7.421 -4.062 -4.752 1.00 0.00 H new ATOM 906 N ALA A 58 5.033 -3.404 -9.275 1.00 0.00 N ATOM 907 CA ALA A 58 4.258 -3.839 -10.475 1.00 0.00 C ATOM 908 C ALA A 58 5.060 -4.856 -11.289 1.00 0.00 C ATOM 909 O ALA A 58 4.516 -5.596 -12.081 1.00 0.00 O ATOM 910 CB ALA A 58 4.014 -2.573 -11.281 1.00 0.00 C ATOM 0 H ALA A 58 5.308 -2.422 -9.260 1.00 0.00 H new ATOM 0 HA ALA A 58 3.322 -4.326 -10.201 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.448 -2.817 -12.180 1.00 0.00 H new ATOM 0 HB2 ALA A 58 3.449 -1.861 -10.679 1.00 0.00 H new ATOM 0 HB3 ALA A 58 4.970 -2.131 -11.563 1.00 0.00 H new ATOM 916 N ALA A 59 6.347 -4.900 -11.094 1.00 0.00 N ATOM 917 CA ALA A 59 7.184 -5.876 -11.851 1.00 0.00 C ATOM 918 C ALA A 59 6.724 -7.307 -11.547 1.00 0.00 C ATOM 919 O ALA A 59 7.094 -8.244 -12.224 1.00 0.00 O ATOM 920 CB ALA A 59 8.610 -5.641 -11.349 1.00 0.00 C ATOM 0 H ALA A 59 6.858 -4.303 -10.443 1.00 0.00 H new ATOM 0 HA ALA A 59 7.110 -5.745 -12.931 1.00 0.00 H new ATOM 0 HB1 ALA A 59 9.292 -6.322 -11.858 1.00 0.00 H new ATOM 0 HB2 ALA A 59 8.904 -4.612 -11.556 1.00 0.00 H new ATOM 0 HB3 ALA A 59 8.652 -5.821 -10.275 1.00 0.00 H new ATOM 926 N ASN A 60 5.913 -7.478 -10.539 1.00 0.00 N ATOM 927 CA ASN A 60 5.423 -8.844 -10.198 1.00 0.00 C ATOM 928 C ASN A 60 4.442 -9.334 -11.272 1.00 0.00 C ATOM 929 O ASN A 60 3.889 -8.545 -12.013 1.00 0.00 O ATOM 930 CB ASN A 60 4.722 -8.669 -8.854 1.00 0.00 C ATOM 931 CG ASN A 60 5.771 -8.510 -7.752 1.00 0.00 C ATOM 932 OD1 ASN A 60 6.942 -8.353 -8.031 1.00 0.00 O ATOM 933 ND2 ASN A 60 5.398 -8.540 -6.502 1.00 0.00 N ATOM 0 H ASN A 60 5.568 -6.731 -9.937 1.00 0.00 H new ATOM 0 HA ASN A 60 6.223 -9.583 -10.148 1.00 0.00 H new ATOM 0 HB2 ASN A 60 4.072 -7.795 -8.881 1.00 0.00 H new ATOM 0 HB3 ASN A 60 4.088 -9.531 -8.647 1.00 0.00 H new ATOM 0 HD21 ASN A 60 6.090 -8.432 -5.761 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.414 -8.672 -6.266 1.00 0.00 H new ATOM 940 N PRO A 61 4.281 -10.629 -11.334 1.00 0.00 N ATOM 941 CA PRO A 61 3.376 -11.245 -12.342 1.00 0.00 C ATOM 942 C PRO A 61 1.896 -11.037 -11.993 1.00 0.00 C ATOM 943 O PRO A 61 1.259 -10.121 -12.476 1.00 0.00 O ATOM 944 CB PRO A 61 3.748 -12.723 -12.294 1.00 0.00 C ATOM 945 CG PRO A 61 4.323 -12.941 -10.930 1.00 0.00 C ATOM 946 CD PRO A 61 4.919 -11.633 -10.477 1.00 0.00 C ATOM 0 HA PRO A 61 3.495 -10.802 -13.331 1.00 0.00 H new ATOM 0 HB2 PRO A 61 2.875 -13.354 -12.458 1.00 0.00 H new ATOM 0 HB3 PRO A 61 4.471 -12.972 -13.070 1.00 0.00 H new ATOM 0 HG2 PRO A 61 3.550 -13.271 -10.236 1.00 0.00 H new ATOM 0 HG3 PRO A 61 5.084 -13.721 -10.955 1.00 0.00 H new ATOM 0 HD2 PRO A 61 4.713 -11.446 -9.423 1.00 0.00 H new ATOM 0 HD3 PRO A 61 6.002 -11.627 -10.596 1.00 0.00 H new ATOM 954 N SER A 62 1.332 -11.888 -11.177 1.00 0.00 N ATOM 955 CA SER A 62 -0.117 -11.743 -10.822 1.00 0.00 C ATOM 956 C SER A 62 -0.333 -10.650 -9.769 1.00 0.00 C ATOM 957 O SER A 62 -1.380 -10.574 -9.154 1.00 0.00 O ATOM 958 CB SER A 62 -0.530 -13.103 -10.270 1.00 0.00 C ATOM 959 OG SER A 62 0.316 -14.106 -10.813 1.00 0.00 O ATOM 0 H SER A 62 1.808 -12.677 -10.740 1.00 0.00 H new ATOM 0 HA SER A 62 -0.709 -11.449 -11.689 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.461 -13.103 -9.182 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.569 -13.311 -10.524 1.00 0.00 H new ATOM 0 HG SER A 62 0.054 -14.982 -10.459 1.00 0.00 H new ATOM 965 N PHE A 63 0.631 -9.800 -9.563 1.00 0.00 N ATOM 966 CA PHE A 63 0.467 -8.710 -8.562 1.00 0.00 C ATOM 967 C PHE A 63 -0.869 -7.992 -8.793 1.00 0.00 C ATOM 968 O PHE A 63 -1.654 -7.809 -7.881 1.00 0.00 O ATOM 969 CB PHE A 63 1.665 -7.794 -8.829 1.00 0.00 C ATOM 970 CG PHE A 63 1.370 -6.377 -8.411 1.00 0.00 C ATOM 971 CD1 PHE A 63 1.118 -6.086 -7.069 1.00 0.00 C ATOM 972 CD2 PHE A 63 1.362 -5.352 -9.366 1.00 0.00 C ATOM 973 CE1 PHE A 63 0.855 -4.774 -6.676 1.00 0.00 C ATOM 974 CE2 PHE A 63 1.096 -4.037 -8.973 1.00 0.00 C ATOM 975 CZ PHE A 63 0.844 -3.748 -7.627 1.00 0.00 C ATOM 0 H PHE A 63 1.529 -9.812 -10.046 1.00 0.00 H new ATOM 0 HA PHE A 63 0.445 -9.056 -7.529 1.00 0.00 H new ATOM 0 HB2 PHE A 63 2.536 -8.162 -8.287 1.00 0.00 H new ATOM 0 HB3 PHE A 63 1.916 -7.819 -9.889 1.00 0.00 H new ATOM 0 HD1 PHE A 63 1.127 -6.878 -6.334 1.00 0.00 H new ATOM 0 HD2 PHE A 63 1.561 -5.577 -10.403 1.00 0.00 H new ATOM 0 HE1 PHE A 63 0.660 -4.550 -5.638 1.00 0.00 H new ATOM 0 HE2 PHE A 63 1.085 -3.245 -9.707 1.00 0.00 H new ATOM 0 HZ PHE A 63 0.641 -2.732 -7.322 1.00 0.00 H new ATOM 985 N ARG A 64 -1.145 -7.601 -10.001 1.00 0.00 N ATOM 986 CA ARG A 64 -2.439 -6.915 -10.286 1.00 0.00 C ATOM 987 C ARG A 64 -3.582 -7.639 -9.581 1.00 0.00 C ATOM 988 O ARG A 64 -4.396 -7.043 -8.903 1.00 0.00 O ATOM 989 CB ARG A 64 -2.614 -7.044 -11.793 1.00 0.00 C ATOM 990 CG ARG A 64 -3.126 -5.731 -12.362 1.00 0.00 C ATOM 991 CD ARG A 64 -2.007 -4.702 -12.292 1.00 0.00 C ATOM 992 NE ARG A 64 -2.109 -3.950 -13.572 1.00 0.00 N ATOM 993 CZ ARG A 64 -1.503 -4.380 -14.649 1.00 0.00 C ATOM 994 NH1 ARG A 64 -0.748 -5.448 -14.611 1.00 0.00 N ATOM 995 NH2 ARG A 64 -1.648 -3.726 -15.767 1.00 0.00 N ATOM 0 H ARG A 64 -0.533 -7.725 -10.807 1.00 0.00 H new ATOM 0 HA ARG A 64 -2.442 -5.880 -9.944 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -1.664 -7.308 -12.258 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -3.314 -7.848 -12.020 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -3.451 -5.867 -13.394 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -3.993 -5.386 -11.798 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -2.129 -4.042 -11.433 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -1.033 -5.181 -12.190 1.00 0.00 H new ATOM 0 HE ARG A 64 -2.657 -3.091 -13.610 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -0.626 -5.956 -13.735 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -0.281 -5.773 -15.458 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -2.229 -2.888 -15.796 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -1.180 -4.052 -16.613 1.00 0.00 H new ATOM 1009 N ALA A 65 -3.645 -8.924 -9.755 1.00 0.00 N ATOM 1010 CA ALA A 65 -4.730 -9.719 -9.114 1.00 0.00 C ATOM 1011 C ALA A 65 -4.677 -9.531 -7.601 1.00 0.00 C ATOM 1012 O ALA A 65 -5.686 -9.405 -6.940 1.00 0.00 O ATOM 1013 CB ALA A 65 -4.420 -11.171 -9.481 1.00 0.00 C ATOM 0 H ALA A 65 -2.988 -9.465 -10.317 1.00 0.00 H new ATOM 0 HA ALA A 65 -5.724 -9.418 -9.445 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -5.175 -11.825 -9.046 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -4.425 -11.281 -10.565 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -3.438 -11.442 -9.094 1.00 0.00 H new ATOM 1019 N VAL A 66 -3.499 -9.509 -7.053 1.00 0.00 N ATOM 1020 CA VAL A 66 -3.365 -9.327 -5.585 1.00 0.00 C ATOM 1021 C VAL A 66 -3.927 -7.970 -5.175 1.00 0.00 C ATOM 1022 O VAL A 66 -4.666 -7.856 -4.215 1.00 0.00 O ATOM 1023 CB VAL A 66 -1.862 -9.380 -5.328 1.00 0.00 C ATOM 1024 CG1 VAL A 66 -1.593 -9.284 -3.823 1.00 0.00 C ATOM 1025 CG2 VAL A 66 -1.307 -10.695 -5.877 1.00 0.00 C ATOM 0 H VAL A 66 -2.620 -9.610 -7.560 1.00 0.00 H new ATOM 0 HA VAL A 66 -3.908 -10.082 -5.017 1.00 0.00 H new ATOM 0 HB VAL A 66 -1.372 -8.544 -5.827 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.519 -9.322 -3.642 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.992 -8.344 -3.441 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -2.076 -10.117 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -0.233 -10.740 -5.697 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -1.794 -11.532 -5.377 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -1.498 -10.751 -6.949 1.00 0.00 H new ATOM 1035 N VAL A 67 -3.580 -6.936 -5.892 1.00 0.00 N ATOM 1036 CA VAL A 67 -4.100 -5.596 -5.523 1.00 0.00 C ATOM 1037 C VAL A 67 -5.620 -5.564 -5.673 1.00 0.00 C ATOM 1038 O VAL A 67 -6.318 -5.002 -4.851 1.00 0.00 O ATOM 1039 CB VAL A 67 -3.444 -4.616 -6.488 1.00 0.00 C ATOM 1040 CG1 VAL A 67 -3.634 -3.199 -5.946 1.00 0.00 C ATOM 1041 CG2 VAL A 67 -1.951 -4.930 -6.604 1.00 0.00 C ATOM 0 H VAL A 67 -2.967 -6.963 -6.707 1.00 0.00 H new ATOM 0 HA VAL A 67 -3.874 -5.343 -4.487 1.00 0.00 H new ATOM 0 HB VAL A 67 -3.899 -4.701 -7.475 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.170 -2.484 -6.626 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -4.699 -2.981 -5.862 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.169 -3.120 -4.963 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -1.484 -4.228 -7.295 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -1.483 -4.840 -5.624 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -1.821 -5.946 -6.976 1.00 0.00 H new ATOM 1051 N GLN A 68 -6.153 -6.168 -6.706 1.00 0.00 N ATOM 1052 CA GLN A 68 -7.634 -6.161 -6.866 1.00 0.00 C ATOM 1053 C GLN A 68 -8.273 -6.793 -5.636 1.00 0.00 C ATOM 1054 O GLN A 68 -9.321 -6.373 -5.184 1.00 0.00 O ATOM 1055 CB GLN A 68 -7.937 -7.000 -8.113 1.00 0.00 C ATOM 1056 CG GLN A 68 -7.454 -6.276 -9.373 1.00 0.00 C ATOM 1057 CD GLN A 68 -7.776 -7.132 -10.600 1.00 0.00 C ATOM 1058 OE1 GLN A 68 -6.996 -7.976 -10.991 1.00 0.00 O ATOM 1059 NE2 GLN A 68 -8.908 -6.950 -11.231 1.00 0.00 N ATOM 0 H GLN A 68 -5.633 -6.658 -7.434 1.00 0.00 H new ATOM 0 HA GLN A 68 -8.028 -5.150 -6.972 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -7.448 -7.971 -8.034 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -9.009 -7.187 -8.182 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -7.939 -5.303 -9.456 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -6.381 -6.094 -9.313 1.00 0.00 H new ATOM 0 HE21 GLN A 68 -9.565 -6.242 -10.905 1.00 0.00 H new ATOM 0 HE22 GLN A 68 -9.133 -7.517 -12.049 1.00 0.00 H new ATOM 1068 N GLN A 69 -7.651 -7.793 -5.074 1.00 0.00 N ATOM 1069 CA GLN A 69 -8.243 -8.420 -3.865 1.00 0.00 C ATOM 1070 C GLN A 69 -8.327 -7.393 -2.740 1.00 0.00 C ATOM 1071 O GLN A 69 -9.364 -7.204 -2.133 1.00 0.00 O ATOM 1072 CB GLN A 69 -7.294 -9.546 -3.474 1.00 0.00 C ATOM 1073 CG GLN A 69 -7.938 -10.367 -2.358 1.00 0.00 C ATOM 1074 CD GLN A 69 -9.066 -11.217 -2.944 1.00 0.00 C ATOM 1075 OE1 GLN A 69 -8.901 -11.835 -3.975 1.00 0.00 O ATOM 1076 NE2 GLN A 69 -10.213 -11.276 -2.324 1.00 0.00 N ATOM 0 H GLN A 69 -6.771 -8.197 -5.396 1.00 0.00 H new ATOM 0 HA GLN A 69 -9.250 -8.791 -4.053 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -7.085 -10.180 -4.336 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.341 -9.137 -3.140 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -7.193 -11.007 -1.885 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -8.329 -9.707 -1.584 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -10.352 -10.756 -1.457 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -10.971 -11.842 -2.706 1.00 0.00 H new ATOM 1085 N LEU A 70 -7.248 -6.717 -2.458 1.00 0.00 N ATOM 1086 CA LEU A 70 -7.288 -5.701 -1.371 1.00 0.00 C ATOM 1087 C LEU A 70 -8.499 -4.788 -1.574 1.00 0.00 C ATOM 1088 O LEU A 70 -9.290 -4.591 -0.677 1.00 0.00 O ATOM 1089 CB LEU A 70 -5.979 -4.927 -1.503 1.00 0.00 C ATOM 1090 CG LEU A 70 -4.894 -5.622 -0.674 1.00 0.00 C ATOM 1091 CD1 LEU A 70 -3.616 -5.746 -1.501 1.00 0.00 C ATOM 1092 CD2 LEU A 70 -4.597 -4.800 0.582 1.00 0.00 C ATOM 0 H LEU A 70 -6.349 -6.823 -2.928 1.00 0.00 H new ATOM 0 HA LEU A 70 -7.385 -6.141 -0.379 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.677 -4.876 -2.549 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -6.114 -3.901 -1.160 1.00 0.00 H new ATOM 0 HG LEU A 70 -5.246 -6.613 -0.389 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -2.846 -6.241 -0.909 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -3.818 -6.333 -2.397 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -3.271 -4.753 -1.788 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -3.825 -5.298 1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -4.250 -3.808 0.294 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.504 -4.708 1.180 1.00 0.00 H new ATOM 1104 N CYS A 71 -8.671 -4.255 -2.753 1.00 0.00 N ATOM 1105 CA CYS A 71 -9.859 -3.393 -2.993 1.00 0.00 C ATOM 1106 C CYS A 71 -11.120 -4.260 -2.958 1.00 0.00 C ATOM 1107 O CYS A 71 -12.155 -3.854 -2.467 1.00 0.00 O ATOM 1108 CB CYS A 71 -9.656 -2.798 -4.383 1.00 0.00 C ATOM 1109 SG CYS A 71 -7.973 -2.156 -4.538 1.00 0.00 S ATOM 0 H CYS A 71 -8.047 -4.378 -3.551 1.00 0.00 H new ATOM 0 HA CYS A 71 -9.971 -2.611 -2.241 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -9.836 -3.558 -5.143 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -10.377 -1.999 -4.555 1.00 0.00 H new ATOM 0 HG CYS A 71 -7.152 -3.140 -4.758 1.00 0.00 H new ATOM 1115 N PHE A 72 -11.034 -5.461 -3.469 1.00 0.00 N ATOM 1116 CA PHE A 72 -12.222 -6.365 -3.456 1.00 0.00 C ATOM 1117 C PHE A 72 -12.675 -6.593 -2.018 1.00 0.00 C ATOM 1118 O PHE A 72 -13.854 -6.636 -1.721 1.00 0.00 O ATOM 1119 CB PHE A 72 -11.730 -7.683 -4.056 1.00 0.00 C ATOM 1120 CG PHE A 72 -12.907 -8.608 -4.256 1.00 0.00 C ATOM 1121 CD1 PHE A 72 -13.427 -9.331 -3.174 1.00 0.00 C ATOM 1122 CD2 PHE A 72 -13.484 -8.736 -5.525 1.00 0.00 C ATOM 1123 CE1 PHE A 72 -14.524 -10.181 -3.363 1.00 0.00 C ATOM 1124 CE2 PHE A 72 -14.580 -9.585 -5.713 1.00 0.00 C ATOM 1125 CZ PHE A 72 -15.102 -10.307 -4.632 1.00 0.00 C ATOM 0 H PHE A 72 -10.194 -5.854 -3.894 1.00 0.00 H new ATOM 0 HA PHE A 72 -13.063 -5.949 -4.011 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -11.231 -7.499 -5.007 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.997 -8.146 -3.395 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -12.982 -9.233 -2.195 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -13.083 -8.179 -6.359 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -14.924 -10.739 -2.530 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -15.024 -9.684 -6.693 1.00 0.00 H new ATOM 0 HZ PHE A 72 -15.950 -10.960 -4.777 1.00 0.00 H new ATOM 1135 N GLU A 73 -11.739 -6.751 -1.130 1.00 0.00 N ATOM 1136 CA GLU A 73 -12.088 -6.986 0.297 1.00 0.00 C ATOM 1137 C GLU A 73 -12.353 -5.657 1.000 1.00 0.00 C ATOM 1138 O GLU A 73 -12.712 -5.617 2.158 1.00 0.00 O ATOM 1139 CB GLU A 73 -10.859 -7.675 0.877 1.00 0.00 C ATOM 1140 CG GLU A 73 -10.584 -8.954 0.087 1.00 0.00 C ATOM 1141 CD GLU A 73 -9.683 -9.879 0.907 1.00 0.00 C ATOM 1142 OE1 GLU A 73 -8.577 -9.474 1.216 1.00 0.00 O ATOM 1143 OE2 GLU A 73 -10.117 -10.979 1.210 1.00 0.00 O ATOM 0 H GLU A 73 -10.739 -6.728 -1.331 1.00 0.00 H new ATOM 0 HA GLU A 73 -12.990 -7.585 0.420 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -9.997 -7.010 0.828 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.021 -7.910 1.929 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -11.522 -9.457 -0.148 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -10.106 -8.712 -0.862 1.00 0.00 H new ATOM 1150 N GLY A 74 -12.184 -4.567 0.307 1.00 0.00 N ATOM 1151 CA GLY A 74 -12.432 -3.244 0.939 1.00 0.00 C ATOM 1152 C GLY A 74 -11.148 -2.743 1.600 1.00 0.00 C ATOM 1153 O GLY A 74 -11.132 -1.699 2.226 1.00 0.00 O ATOM 0 H GLY A 74 -11.885 -4.535 -0.668 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -12.770 -2.529 0.189 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -13.226 -3.327 1.681 1.00 0.00 H new ATOM 1157 N VAL A 75 -10.066 -3.467 1.467 1.00 0.00 N ATOM 1158 CA VAL A 75 -8.798 -3.003 2.094 1.00 0.00 C ATOM 1159 C VAL A 75 -8.101 -1.999 1.183 1.00 0.00 C ATOM 1160 O VAL A 75 -7.436 -2.365 0.234 1.00 0.00 O ATOM 1161 CB VAL A 75 -7.928 -4.246 2.249 1.00 0.00 C ATOM 1162 CG1 VAL A 75 -6.671 -3.881 3.040 1.00 0.00 C ATOM 1163 CG2 VAL A 75 -8.703 -5.332 2.993 1.00 0.00 C ATOM 0 H VAL A 75 -10.008 -4.349 0.957 1.00 0.00 H new ATOM 0 HA VAL A 75 -8.982 -2.515 3.051 1.00 0.00 H new ATOM 0 HB VAL A 75 -7.649 -4.620 1.264 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.044 -4.765 3.155 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.116 -3.110 2.506 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -6.956 -3.508 4.024 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -8.076 -6.217 3.101 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -8.986 -4.966 3.980 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -9.600 -5.589 2.430 1.00 0.00 H new ATOM 1173 N VAL A 76 -8.233 -0.738 1.472 1.00 0.00 N ATOM 1174 CA VAL A 76 -7.560 0.286 0.633 1.00 0.00 C ATOM 1175 C VAL A 76 -6.609 1.103 1.505 1.00 0.00 C ATOM 1176 O VAL A 76 -6.985 1.635 2.531 1.00 0.00 O ATOM 1177 CB VAL A 76 -8.683 1.152 0.066 1.00 0.00 C ATOM 1178 CG1 VAL A 76 -8.143 1.986 -1.098 1.00 0.00 C ATOM 1179 CG2 VAL A 76 -9.812 0.252 -0.440 1.00 0.00 C ATOM 0 H VAL A 76 -8.778 -0.372 2.253 1.00 0.00 H new ATOM 0 HA VAL A 76 -6.965 -0.148 -0.171 1.00 0.00 H new ATOM 0 HB VAL A 76 -9.062 1.813 0.846 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -8.943 2.605 -1.504 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -7.334 2.625 -0.743 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -7.766 1.323 -1.877 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -10.615 0.868 -0.845 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -9.431 -0.406 -1.221 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -10.196 -0.348 0.385 1.00 0.00 H new ATOM 1189 N VAL A 77 -5.373 1.187 1.116 1.00 0.00 N ATOM 1190 CA VAL A 77 -4.381 1.947 1.925 1.00 0.00 C ATOM 1191 C VAL A 77 -3.497 2.781 1.008 1.00 0.00 C ATOM 1192 O VAL A 77 -3.451 2.545 -0.181 1.00 0.00 O ATOM 1193 CB VAL A 77 -3.549 0.861 2.609 1.00 0.00 C ATOM 1194 CG1 VAL A 77 -4.381 0.180 3.700 1.00 0.00 C ATOM 1195 CG2 VAL A 77 -3.130 -0.179 1.561 1.00 0.00 C ATOM 0 H VAL A 77 -5.002 0.760 0.267 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.847 2.631 2.635 1.00 0.00 H new ATOM 0 HB VAL A 77 -2.665 1.309 3.063 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -3.784 -0.593 4.184 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.686 0.920 4.440 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -5.266 -0.272 3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -2.536 -0.958 2.039 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -4.019 -0.623 1.114 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.537 0.305 0.785 1.00 0.00 H new ATOM 1205 N PRO A 78 -2.791 3.714 1.589 1.00 0.00 N ATOM 1206 CA PRO A 78 -1.877 4.555 0.789 1.00 0.00 C ATOM 1207 C PRO A 78 -0.760 3.667 0.258 1.00 0.00 C ATOM 1208 O PRO A 78 0.266 3.482 0.886 1.00 0.00 O ATOM 1209 CB PRO A 78 -1.363 5.585 1.788 1.00 0.00 C ATOM 1210 CG PRO A 78 -1.543 4.942 3.121 1.00 0.00 C ATOM 1211 CD PRO A 78 -2.764 4.067 3.012 1.00 0.00 C ATOM 0 HA PRO A 78 -2.336 5.039 -0.073 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.316 5.828 1.603 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -1.923 6.517 1.719 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -0.666 4.353 3.389 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -1.672 5.693 3.900 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.685 3.184 3.646 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -3.668 4.596 3.314 1.00 0.00 H new ATOM 1219 N ALA A 79 -0.979 3.071 -0.876 1.00 0.00 N ATOM 1220 CA ALA A 79 0.030 2.145 -1.438 1.00 0.00 C ATOM 1221 C ALA A 79 0.968 2.847 -2.428 1.00 0.00 C ATOM 1222 O ALA A 79 0.550 3.651 -3.238 1.00 0.00 O ATOM 1223 CB ALA A 79 -0.802 1.086 -2.155 1.00 0.00 C ATOM 0 H ALA A 79 -1.821 3.188 -1.440 1.00 0.00 H new ATOM 0 HA ALA A 79 0.678 1.735 -0.663 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.140 0.348 -2.608 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -1.459 0.593 -1.438 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.403 1.560 -2.931 1.00 0.00 H new ATOM 1229 N ILE A 80 2.231 2.519 -2.373 1.00 0.00 N ATOM 1230 CA ILE A 80 3.215 3.126 -3.316 1.00 0.00 C ATOM 1231 C ILE A 80 3.666 2.048 -4.311 1.00 0.00 C ATOM 1232 O ILE A 80 4.155 1.006 -3.922 1.00 0.00 O ATOM 1233 CB ILE A 80 4.376 3.580 -2.429 1.00 0.00 C ATOM 1234 CG1 ILE A 80 3.837 4.465 -1.298 1.00 0.00 C ATOM 1235 CG2 ILE A 80 5.382 4.372 -3.270 1.00 0.00 C ATOM 1236 CD1 ILE A 80 4.839 4.490 -0.144 1.00 0.00 C ATOM 0 H ILE A 80 2.626 1.852 -1.710 1.00 0.00 H new ATOM 0 HA ILE A 80 2.812 3.958 -3.893 1.00 0.00 H new ATOM 0 HB ILE A 80 4.872 2.709 -2.001 1.00 0.00 H new ATOM 0 HG12 ILE A 80 3.665 5.477 -1.665 1.00 0.00 H new ATOM 0 HG13 ILE A 80 2.877 4.084 -0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.209 4.696 -2.638 1.00 0.00 H new ATOM 0 HG22 ILE A 80 5.763 3.740 -4.072 1.00 0.00 H new ATOM 0 HG23 ILE A 80 4.890 5.245 -3.699 1.00 0.00 H new ATOM 0 HD11 ILE A 80 4.454 5.119 0.658 1.00 0.00 H new ATOM 0 HD12 ILE A 80 4.989 3.477 0.229 1.00 0.00 H new ATOM 0 HD13 ILE A 80 5.789 4.891 -0.496 1.00 0.00 H new ATOM 1248 N VAL A 81 3.483 2.267 -5.587 1.00 0.00 N ATOM 1249 CA VAL A 81 3.880 1.219 -6.576 1.00 0.00 C ATOM 1250 C VAL A 81 5.273 1.492 -7.161 1.00 0.00 C ATOM 1251 O VAL A 81 5.662 2.625 -7.365 1.00 0.00 O ATOM 1252 CB VAL A 81 2.814 1.287 -7.672 1.00 0.00 C ATOM 1253 CG1 VAL A 81 3.029 0.137 -8.656 1.00 0.00 C ATOM 1254 CG2 VAL A 81 1.424 1.160 -7.044 1.00 0.00 C ATOM 0 H VAL A 81 3.081 3.116 -5.985 1.00 0.00 H new ATOM 0 HA VAL A 81 3.938 0.235 -6.112 1.00 0.00 H new ATOM 0 HB VAL A 81 2.891 2.240 -8.195 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.272 0.181 -9.439 1.00 0.00 H new ATOM 0 HG12 VAL A 81 4.019 0.222 -9.104 1.00 0.00 H new ATOM 0 HG13 VAL A 81 2.950 -0.813 -8.128 1.00 0.00 H new ATOM 0 HG21 VAL A 81 0.666 1.209 -7.826 1.00 0.00 H new ATOM 0 HG22 VAL A 81 1.346 0.206 -6.522 1.00 0.00 H new ATOM 0 HG23 VAL A 81 1.269 1.975 -6.337 1.00 0.00 H new ATOM 1264 N VAL A 82 6.025 0.451 -7.436 1.00 0.00 N ATOM 1265 CA VAL A 82 7.392 0.637 -8.016 1.00 0.00 C ATOM 1266 C VAL A 82 7.440 0.104 -9.453 1.00 0.00 C ATOM 1267 O VAL A 82 7.048 -1.015 -9.719 1.00 0.00 O ATOM 1268 CB VAL A 82 8.320 -0.197 -7.132 1.00 0.00 C ATOM 1269 CG1 VAL A 82 9.776 0.117 -7.485 1.00 0.00 C ATOM 1270 CG2 VAL A 82 8.071 0.135 -5.662 1.00 0.00 C ATOM 0 H VAL A 82 5.750 -0.519 -7.283 1.00 0.00 H new ATOM 0 HA VAL A 82 7.677 1.689 -8.046 1.00 0.00 H new ATOM 0 HB VAL A 82 8.122 -1.256 -7.300 1.00 0.00 H new ATOM 0 HG11 VAL A 82 10.439 -0.477 -6.856 1.00 0.00 H new ATOM 0 HG12 VAL A 82 9.957 -0.125 -8.532 1.00 0.00 H new ATOM 0 HG13 VAL A 82 9.970 1.177 -7.319 1.00 0.00 H new ATOM 0 HG21 VAL A 82 8.735 -0.462 -5.037 1.00 0.00 H new ATOM 0 HG22 VAL A 82 8.265 1.194 -5.490 1.00 0.00 H new ATOM 0 HG23 VAL A 82 7.035 -0.089 -5.409 1.00 0.00 H new ATOM 1280 N GLY A 83 7.939 0.880 -10.379 1.00 0.00 N ATOM 1281 CA GLY A 83 8.028 0.396 -11.790 1.00 0.00 C ATOM 1282 C GLY A 83 6.720 0.674 -12.531 1.00 0.00 C ATOM 1283 O GLY A 83 5.830 1.331 -12.027 1.00 0.00 O ATOM 0 H GLY A 83 8.288 1.825 -10.221 1.00 0.00 H new ATOM 0 HA2 GLY A 83 8.855 0.891 -12.300 1.00 0.00 H new ATOM 0 HA3 GLY A 83 8.240 -0.673 -11.802 1.00 0.00 H new ATOM 1492 N LEU A 98 -2.958 -0.041 -10.943 1.00 0.00 N ATOM 1493 CA LEU A 98 -2.393 -1.188 -10.189 1.00 0.00 C ATOM 1494 C LEU A 98 -3.103 -1.245 -8.849 1.00 0.00 C ATOM 1495 O LEU A 98 -3.300 -2.291 -8.273 1.00 0.00 O ATOM 1496 CB LEU A 98 -0.910 -0.863 -10.004 1.00 0.00 C ATOM 1497 CG LEU A 98 -0.227 -0.811 -11.371 1.00 0.00 C ATOM 1498 CD1 LEU A 98 1.203 -0.289 -11.219 1.00 0.00 C ATOM 1499 CD2 LEU A 98 -0.194 -2.215 -11.969 1.00 0.00 C ATOM 0 HA LEU A 98 -2.516 -2.148 -10.691 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -0.797 0.093 -9.492 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -0.436 -1.618 -9.377 1.00 0.00 H new ATOM 0 HG LEU A 98 -0.783 -0.142 -12.028 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.684 -0.255 -12.197 1.00 0.00 H new ATOM 0 HD12 LEU A 98 1.181 0.713 -10.790 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.765 -0.953 -10.562 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.292 -2.184 -12.944 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.362 -2.879 -11.307 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.213 -2.586 -12.083 1.00 0.00 H new ATOM 1511 N TYR A 99 -3.512 -0.105 -8.374 1.00 0.00 N ATOM 1512 CA TYR A 99 -4.246 -0.038 -7.083 1.00 0.00 C ATOM 1513 C TYR A 99 -5.309 1.064 -7.178 1.00 0.00 C ATOM 1514 O TYR A 99 -5.999 1.172 -8.171 1.00 0.00 O ATOM 1515 CB TYR A 99 -3.185 0.281 -6.018 1.00 0.00 C ATOM 1516 CG TYR A 99 -3.590 -0.288 -4.668 1.00 0.00 C ATOM 1517 CD1 TYR A 99 -4.939 -0.539 -4.374 1.00 0.00 C ATOM 1518 CD2 TYR A 99 -2.609 -0.552 -3.700 1.00 0.00 C ATOM 1519 CE1 TYR A 99 -5.300 -1.050 -3.118 1.00 0.00 C ATOM 1520 CE2 TYR A 99 -2.973 -1.065 -2.448 1.00 0.00 C ATOM 1521 CZ TYR A 99 -4.317 -1.311 -2.159 1.00 0.00 C ATOM 1522 OH TYR A 99 -4.676 -1.812 -0.925 1.00 0.00 O ATOM 0 H TYR A 99 -3.367 0.795 -8.831 1.00 0.00 H new ATOM 0 HA TYR A 99 -4.763 -0.965 -6.833 1.00 0.00 H new ATOM 0 HB2 TYR A 99 -2.224 -0.135 -6.320 1.00 0.00 H new ATOM 0 HB3 TYR A 99 -3.055 1.360 -5.939 1.00 0.00 H new ATOM 0 HD1 TYR A 99 -5.699 -0.339 -5.114 1.00 0.00 H new ATOM 0 HD2 TYR A 99 -1.570 -0.359 -3.921 1.00 0.00 H new ATOM 0 HE1 TYR A 99 -6.339 -1.242 -2.892 1.00 0.00 H new ATOM 0 HE2 TYR A 99 -2.215 -1.270 -1.707 1.00 0.00 H new ATOM 0 HH TYR A 99 -5.653 -1.819 -0.846 1.00 0.00 H new ATOM 1532 N HIS A 100 -5.456 1.888 -6.175 1.00 0.00 N ATOM 1533 CA HIS A 100 -6.485 2.968 -6.264 1.00 0.00 C ATOM 1534 C HIS A 100 -5.846 4.285 -6.728 1.00 0.00 C ATOM 1535 O HIS A 100 -4.655 4.363 -6.953 1.00 0.00 O ATOM 1536 CB HIS A 100 -7.064 3.106 -4.857 1.00 0.00 C ATOM 1537 CG HIS A 100 -5.952 3.287 -3.869 1.00 0.00 C ATOM 1538 ND1 HIS A 100 -5.424 4.543 -3.563 1.00 0.00 N ATOM 1539 CD2 HIS A 100 -5.243 2.385 -3.111 1.00 0.00 C ATOM 1540 CE1 HIS A 100 -4.442 4.365 -2.655 1.00 0.00 C ATOM 1541 NE2 HIS A 100 -4.312 3.079 -2.369 1.00 0.00 N ATOM 0 H HIS A 100 -4.917 1.863 -5.309 1.00 0.00 H new ATOM 0 HA HIS A 100 -7.262 2.727 -6.990 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -7.743 3.957 -4.815 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -7.647 2.220 -4.605 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -5.391 1.315 -3.099 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -3.848 5.157 -2.224 1.00 0.00 H new ATOM 0 HE2 HIS A 100 -3.642 2.674 -1.716 1.00 0.00 H new ATOM 1549 N SER A 101 -6.639 5.311 -6.887 1.00 0.00 N ATOM 1550 CA SER A 101 -6.099 6.625 -7.358 1.00 0.00 C ATOM 1551 C SER A 101 -5.154 7.246 -6.329 1.00 0.00 C ATOM 1552 O SER A 101 -4.321 8.068 -6.660 1.00 0.00 O ATOM 1553 CB SER A 101 -7.332 7.511 -7.542 1.00 0.00 C ATOM 1554 OG SER A 101 -8.216 6.900 -8.468 1.00 0.00 O ATOM 0 H SER A 101 -7.644 5.298 -6.710 1.00 0.00 H new ATOM 0 HA SER A 101 -5.519 6.511 -8.274 1.00 0.00 H new ATOM 0 HB2 SER A 101 -7.834 7.658 -6.586 1.00 0.00 H new ATOM 0 HB3 SER A 101 -7.035 8.496 -7.901 1.00 0.00 H new ATOM 0 HG SER A 101 -9.008 7.465 -8.586 1.00 0.00 H new ATOM 1560 N ALA A 102 -5.277 6.881 -5.085 1.00 0.00 N ATOM 1561 CA ALA A 102 -4.384 7.480 -4.056 1.00 0.00 C ATOM 1562 C ALA A 102 -3.026 6.779 -4.059 1.00 0.00 C ATOM 1563 O ALA A 102 -2.030 7.341 -3.649 1.00 0.00 O ATOM 1564 CB ALA A 102 -5.112 7.295 -2.724 1.00 0.00 C ATOM 0 H ALA A 102 -5.952 6.199 -4.738 1.00 0.00 H new ATOM 0 HA ALA A 102 -4.183 8.534 -4.247 1.00 0.00 H new ATOM 0 HB1 ALA A 102 -4.509 7.715 -1.919 1.00 0.00 H new ATOM 0 HB2 ALA A 102 -6.074 7.806 -2.761 1.00 0.00 H new ATOM 0 HB3 ALA A 102 -5.272 6.232 -2.541 1.00 0.00 H new ATOM 1570 N GLU A 103 -2.966 5.562 -4.527 1.00 0.00 N ATOM 1571 CA GLU A 103 -1.665 4.848 -4.568 1.00 0.00 C ATOM 1572 C GLU A 103 -0.611 5.728 -5.253 1.00 0.00 C ATOM 1573 O GLU A 103 -0.846 6.279 -6.310 1.00 0.00 O ATOM 1574 CB GLU A 103 -1.941 3.590 -5.401 1.00 0.00 C ATOM 1575 CG GLU A 103 -1.932 3.940 -6.895 1.00 0.00 C ATOM 1576 CD GLU A 103 -2.425 2.744 -7.714 1.00 0.00 C ATOM 1577 OE1 GLU A 103 -1.795 1.702 -7.642 1.00 0.00 O ATOM 1578 OE2 GLU A 103 -3.419 2.894 -8.408 1.00 0.00 O ATOM 0 H GLU A 103 -3.763 5.034 -4.882 1.00 0.00 H new ATOM 0 HA GLU A 103 -1.284 4.606 -3.576 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -1.186 2.832 -5.192 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -2.906 3.164 -5.124 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -2.569 4.805 -7.079 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -0.924 4.215 -7.207 1.00 0.00 H new ATOM 1585 N LEU A 104 0.548 5.855 -4.672 1.00 0.00 N ATOM 1586 CA LEU A 104 1.606 6.689 -5.310 1.00 0.00 C ATOM 1587 C LEU A 104 2.552 5.801 -6.112 1.00 0.00 C ATOM 1588 O LEU A 104 2.666 4.615 -5.867 1.00 0.00 O ATOM 1589 CB LEU A 104 2.361 7.356 -4.158 1.00 0.00 C ATOM 1590 CG LEU A 104 1.721 8.709 -3.847 1.00 0.00 C ATOM 1591 CD1 LEU A 104 0.278 8.495 -3.397 1.00 0.00 C ATOM 1592 CD2 LEU A 104 2.502 9.399 -2.727 1.00 0.00 C ATOM 0 H LEU A 104 0.809 5.420 -3.787 1.00 0.00 H new ATOM 0 HA LEU A 104 1.184 7.426 -5.994 1.00 0.00 H new ATOM 0 HB2 LEU A 104 2.336 6.718 -3.275 1.00 0.00 H new ATOM 0 HB3 LEU A 104 3.409 7.490 -4.425 1.00 0.00 H new ATOM 0 HG LEU A 104 1.738 9.332 -4.741 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -0.180 9.459 -3.175 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -0.282 8.002 -4.192 1.00 0.00 H new ATOM 0 HD13 LEU A 104 0.264 7.872 -2.503 1.00 0.00 H new ATOM 0 HD21 LEU A 104 2.045 10.364 -2.506 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.484 8.775 -1.833 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.534 9.550 -3.043 1.00 0.00 H new ATOM 1604 N HIS A 105 3.240 6.360 -7.065 1.00 0.00 N ATOM 1605 CA HIS A 105 4.184 5.538 -7.870 1.00 0.00 C ATOM 1606 C HIS A 105 5.623 5.911 -7.528 1.00 0.00 C ATOM 1607 O HIS A 105 5.935 7.056 -7.262 1.00 0.00 O ATOM 1608 CB HIS A 105 3.886 5.876 -9.328 1.00 0.00 C ATOM 1609 CG HIS A 105 2.556 5.300 -9.719 1.00 0.00 C ATOM 1610 ND1 HIS A 105 2.143 5.233 -11.040 1.00 0.00 N ATOM 1611 CD2 HIS A 105 1.533 4.759 -8.978 1.00 0.00 C ATOM 1612 CE1 HIS A 105 0.922 4.668 -11.056 1.00 0.00 C ATOM 1613 NE2 HIS A 105 0.503 4.359 -9.826 1.00 0.00 N ATOM 0 H HIS A 105 3.191 7.346 -7.321 1.00 0.00 H new ATOM 0 HA HIS A 105 4.065 4.473 -7.671 1.00 0.00 H new ATOM 0 HB2 HIS A 105 3.880 6.957 -9.467 1.00 0.00 H new ATOM 0 HB3 HIS A 105 4.670 5.476 -9.972 1.00 0.00 H new ATOM 0 HD2 HIS A 105 1.528 4.659 -7.903 1.00 0.00 H new ATOM 0 HE1 HIS A 105 0.350 4.486 -11.954 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -0.381 3.924 -9.564 1.00 0.00 H new ATOM 1621 N LEU A 106 6.504 4.954 -7.531 1.00 0.00 N ATOM 1622 CA LEU A 106 7.922 5.254 -7.209 1.00 0.00 C ATOM 1623 C LEU A 106 8.835 4.665 -8.279 1.00 0.00 C ATOM 1624 O LEU A 106 8.669 3.535 -8.693 1.00 0.00 O ATOM 1625 CB LEU A 106 8.177 4.576 -5.863 1.00 0.00 C ATOM 1626 CG LEU A 106 9.602 4.883 -5.400 1.00 0.00 C ATOM 1627 CD1 LEU A 106 9.832 6.395 -5.417 1.00 0.00 C ATOM 1628 CD2 LEU A 106 9.793 4.363 -3.976 1.00 0.00 C ATOM 0 H LEU A 106 6.303 3.977 -7.743 1.00 0.00 H new ATOM 0 HA LEU A 106 8.119 6.325 -7.170 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.459 4.930 -5.123 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.037 3.499 -5.954 1.00 0.00 H new ATOM 0 HG LEU A 106 10.313 4.398 -6.069 1.00 0.00 H new ATOM 0 HD11 LEU A 106 10.848 6.612 -5.087 1.00 0.00 H new ATOM 0 HD12 LEU A 106 9.691 6.773 -6.430 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.121 6.879 -4.747 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.808 4.580 -3.642 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.080 4.852 -3.312 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.627 3.286 -3.957 1.00 0.00 H new ATOM 1640 N GLY A 107 9.807 5.407 -8.723 1.00 0.00 N ATOM 1641 CA GLY A 107 10.725 4.857 -9.751 1.00 0.00 C ATOM 1642 C GLY A 107 11.439 3.655 -9.139 1.00 0.00 C ATOM 1643 O GLY A 107 11.721 3.630 -7.960 1.00 0.00 O ATOM 0 H GLY A 107 10.004 6.361 -8.422 1.00 0.00 H new ATOM 0 HA2 GLY A 107 10.169 4.560 -10.640 1.00 0.00 H new ATOM 0 HA3 GLY A 107 11.446 5.612 -10.063 1.00 0.00 H new ATOM 1647 N ILE A 108 11.727 2.654 -9.918 1.00 0.00 N ATOM 1648 CA ILE A 108 12.406 1.464 -9.368 1.00 0.00 C ATOM 1649 C ILE A 108 13.760 1.852 -8.775 1.00 0.00 C ATOM 1650 O ILE A 108 14.119 1.441 -7.688 1.00 0.00 O ATOM 1651 CB ILE A 108 12.596 0.564 -10.575 1.00 0.00 C ATOM 1652 CG1 ILE A 108 11.236 0.212 -11.185 1.00 0.00 C ATOM 1653 CG2 ILE A 108 13.299 -0.703 -10.135 1.00 0.00 C ATOM 1654 CD1 ILE A 108 11.453 -0.568 -12.484 1.00 0.00 C ATOM 0 H ILE A 108 11.518 2.613 -10.916 1.00 0.00 H new ATOM 0 HA ILE A 108 11.841 0.985 -8.568 1.00 0.00 H new ATOM 0 HB ILE A 108 13.195 1.080 -11.325 1.00 0.00 H new ATOM 0 HG12 ILE A 108 10.652 -0.383 -10.483 1.00 0.00 H new ATOM 0 HG13 ILE A 108 10.667 1.120 -11.383 1.00 0.00 H new ATOM 0 HG21 ILE A 108 13.441 -1.358 -10.995 1.00 0.00 H new ATOM 0 HG22 ILE A 108 14.269 -0.451 -9.707 1.00 0.00 H new ATOM 0 HG23 ILE A 108 12.694 -1.214 -9.386 1.00 0.00 H new ATOM 0 HD11 ILE A 108 10.488 -0.821 -12.922 1.00 0.00 H new ATOM 0 HD12 ILE A 108 12.021 0.044 -13.185 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.006 -1.483 -12.271 1.00 0.00 H new ATOM 1666 N HIS A 109 14.512 2.641 -9.485 1.00 0.00 N ATOM 1667 CA HIS A 109 15.845 3.056 -8.978 1.00 0.00 C ATOM 1668 C HIS A 109 15.707 4.267 -8.055 1.00 0.00 C ATOM 1669 O HIS A 109 16.686 4.842 -7.625 1.00 0.00 O ATOM 1670 CB HIS A 109 16.642 3.422 -10.227 1.00 0.00 C ATOM 1671 CG HIS A 109 16.084 4.685 -10.834 1.00 0.00 C ATOM 1672 ND1 HIS A 109 15.285 4.674 -11.968 1.00 0.00 N ATOM 1673 CD2 HIS A 109 16.208 6.007 -10.479 1.00 0.00 C ATOM 1674 CE1 HIS A 109 14.961 5.951 -12.252 1.00 0.00 C ATOM 1675 NE2 HIS A 109 15.499 6.803 -11.375 1.00 0.00 N ATOM 0 H HIS A 109 14.259 3.018 -10.399 1.00 0.00 H new ATOM 0 HA HIS A 109 16.331 2.271 -8.398 1.00 0.00 H new ATOM 0 HB2 HIS A 109 17.692 3.563 -9.972 1.00 0.00 H new ATOM 0 HB3 HIS A 109 16.596 2.608 -10.951 1.00 0.00 H new ATOM 0 HD2 HIS A 109 16.770 6.373 -9.633 1.00 0.00 H new ATOM 0 HE1 HIS A 109 14.343 6.249 -13.086 1.00 0.00 H new ATOM 0 HE2 HIS A 109 15.410 7.819 -11.364 1.00 0.00 H new ATOM 1683 N GLN A 110 14.504 4.659 -7.749 1.00 0.00 N ATOM 1684 CA GLN A 110 14.326 5.831 -6.851 1.00 0.00 C ATOM 1685 C GLN A 110 13.958 5.364 -5.443 1.00 0.00 C ATOM 1686 O GLN A 110 13.467 6.126 -4.637 1.00 0.00 O ATOM 1687 CB GLN A 110 13.201 6.656 -7.480 1.00 0.00 C ATOM 1688 CG GLN A 110 13.628 7.086 -8.886 1.00 0.00 C ATOM 1689 CD GLN A 110 12.636 8.105 -9.459 1.00 0.00 C ATOM 1690 OE1 GLN A 110 12.855 8.642 -10.527 1.00 0.00 O ATOM 1691 NE2 GLN A 110 11.555 8.405 -8.794 1.00 0.00 N ATOM 0 H GLN A 110 13.643 4.223 -8.078 1.00 0.00 H new ATOM 0 HA GLN A 110 15.237 6.421 -6.751 1.00 0.00 H new ATOM 0 HB2 GLN A 110 12.284 6.069 -7.528 1.00 0.00 H new ATOM 0 HB3 GLN A 110 12.987 7.531 -6.867 1.00 0.00 H new ATOM 0 HG2 GLN A 110 14.627 7.521 -8.852 1.00 0.00 H new ATOM 0 HG3 GLN A 110 13.682 6.215 -9.539 1.00 0.00 H new ATOM 0 HE21 GLN A 110 11.367 7.957 -7.897 1.00 0.00 H new ATOM 0 HE22 GLN A 110 10.897 9.088 -9.171 1.00 0.00 H new ATOM 1700 N LEU A 111 14.203 4.117 -5.136 1.00 0.00 N ATOM 1701 CA LEU A 111 13.875 3.621 -3.771 1.00 0.00 C ATOM 1702 C LEU A 111 14.581 4.498 -2.743 1.00 0.00 C ATOM 1703 O LEU A 111 15.755 4.348 -2.467 1.00 0.00 O ATOM 1704 CB LEU A 111 14.388 2.175 -3.717 1.00 0.00 C ATOM 1705 CG LEU A 111 13.455 1.204 -4.484 1.00 0.00 C ATOM 1706 CD1 LEU A 111 12.843 0.204 -3.503 1.00 0.00 C ATOM 1707 CD2 LEU A 111 12.313 1.949 -5.191 1.00 0.00 C ATOM 0 H LEU A 111 14.612 3.428 -5.766 1.00 0.00 H new ATOM 0 HA LEU A 111 12.808 3.656 -3.553 1.00 0.00 H new ATOM 0 HB2 LEU A 111 15.390 2.129 -4.143 1.00 0.00 H new ATOM 0 HB3 LEU A 111 14.469 1.857 -2.678 1.00 0.00 H new ATOM 0 HG LEU A 111 14.058 0.695 -5.236 1.00 0.00 H new ATOM 0 HD11 LEU A 111 12.187 -0.479 -4.042 1.00 0.00 H new ATOM 0 HD12 LEU A 111 13.638 -0.363 -3.018 1.00 0.00 H new ATOM 0 HD13 LEU A 111 12.268 0.740 -2.748 1.00 0.00 H new ATOM 0 HD21 LEU A 111 11.682 1.233 -5.717 1.00 0.00 H new ATOM 0 HD22 LEU A 111 11.716 2.485 -4.453 1.00 0.00 H new ATOM 0 HD23 LEU A 111 12.729 2.659 -5.906 1.00 0.00 H new ATOM 1719 N GLU A 112 13.849 5.419 -2.195 1.00 0.00 N ATOM 1720 CA GLU A 112 14.402 6.371 -1.186 1.00 0.00 C ATOM 1721 C GLU A 112 13.316 7.403 -0.863 1.00 0.00 C ATOM 1722 O GLU A 112 13.267 7.967 0.213 1.00 0.00 O ATOM 1723 CB GLU A 112 15.613 7.046 -1.866 1.00 0.00 C ATOM 1724 CG GLU A 112 15.158 8.283 -2.648 1.00 0.00 C ATOM 1725 CD GLU A 112 16.322 8.826 -3.480 1.00 0.00 C ATOM 1726 OE1 GLU A 112 17.445 8.757 -3.008 1.00 0.00 O ATOM 1727 OE2 GLU A 112 16.071 9.300 -4.575 1.00 0.00 O ATOM 0 H GLU A 112 12.861 5.560 -2.407 1.00 0.00 H new ATOM 0 HA GLU A 112 14.704 5.886 -0.258 1.00 0.00 H new ATOM 0 HB2 GLU A 112 16.349 7.332 -1.114 1.00 0.00 H new ATOM 0 HB3 GLU A 112 16.102 6.341 -2.538 1.00 0.00 H new ATOM 0 HG2 GLU A 112 14.322 8.026 -3.299 1.00 0.00 H new ATOM 0 HG3 GLU A 112 14.802 9.049 -1.960 1.00 0.00 H new ATOM 1734 N GLN A 113 12.449 7.648 -1.817 1.00 0.00 N ATOM 1735 CA GLN A 113 11.346 8.633 -1.618 1.00 0.00 C ATOM 1736 C GLN A 113 10.175 7.973 -0.887 1.00 0.00 C ATOM 1737 O GLN A 113 9.186 8.600 -0.566 1.00 0.00 O ATOM 1738 CB GLN A 113 10.938 9.037 -3.035 1.00 0.00 C ATOM 1739 CG GLN A 113 11.998 9.975 -3.610 1.00 0.00 C ATOM 1740 CD GLN A 113 11.649 10.330 -5.053 1.00 0.00 C ATOM 1741 OE1 GLN A 113 10.507 10.599 -5.368 1.00 0.00 O ATOM 1742 NE2 GLN A 113 12.594 10.343 -5.951 1.00 0.00 N ATOM 0 H GLN A 113 12.462 7.201 -2.734 1.00 0.00 H new ATOM 0 HA GLN A 113 11.649 9.489 -1.015 1.00 0.00 H new ATOM 0 HB2 GLN A 113 10.837 8.153 -3.664 1.00 0.00 H new ATOM 0 HB3 GLN A 113 9.966 9.531 -3.021 1.00 0.00 H new ATOM 0 HG2 GLN A 113 12.059 10.881 -3.008 1.00 0.00 H new ATOM 0 HG3 GLN A 113 12.978 9.499 -3.570 1.00 0.00 H new ATOM 0 HE21 GLN A 113 13.553 10.117 -5.686 1.00 0.00 H new ATOM 0 HE22 GLN A 113 12.375 10.579 -6.919 1.00 0.00 H new ATOM 1751 N LEU A 114 10.295 6.706 -0.618 1.00 0.00 N ATOM 1752 CA LEU A 114 9.219 5.970 0.094 1.00 0.00 C ATOM 1753 C LEU A 114 8.767 6.684 1.375 1.00 0.00 C ATOM 1754 O LEU A 114 7.586 6.743 1.646 1.00 0.00 O ATOM 1755 CB LEU A 114 9.851 4.628 0.428 1.00 0.00 C ATOM 1756 CG LEU A 114 9.903 3.771 -0.833 1.00 0.00 C ATOM 1757 CD1 LEU A 114 11.354 3.403 -1.152 1.00 0.00 C ATOM 1758 CD2 LEU A 114 9.084 2.500 -0.613 1.00 0.00 C ATOM 0 H LEU A 114 11.107 6.140 -0.866 1.00 0.00 H new ATOM 0 HA LEU A 114 8.320 5.887 -0.517 1.00 0.00 H new ATOM 0 HB2 LEU A 114 10.856 4.774 0.825 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.273 4.123 1.202 1.00 0.00 H new ATOM 0 HG LEU A 114 9.488 4.332 -1.670 1.00 0.00 H new ATOM 0 HD11 LEU A 114 11.384 2.791 -2.053 1.00 0.00 H new ATOM 0 HD12 LEU A 114 11.933 4.312 -1.311 1.00 0.00 H new ATOM 0 HD13 LEU A 114 11.779 2.843 -0.319 1.00 0.00 H new ATOM 0 HD21 LEU A 114 9.119 1.885 -1.512 1.00 0.00 H new ATOM 0 HD22 LEU A 114 9.499 1.941 0.226 1.00 0.00 H new ATOM 0 HD23 LEU A 114 8.050 2.767 -0.395 1.00 0.00 H new ATOM 1770 N PRO A 115 9.700 7.184 2.151 1.00 0.00 N ATOM 1771 CA PRO A 115 9.317 7.858 3.412 1.00 0.00 C ATOM 1772 C PRO A 115 8.542 9.134 3.097 1.00 0.00 C ATOM 1773 O PRO A 115 7.463 9.354 3.609 1.00 0.00 O ATOM 1774 CB PRO A 115 10.652 8.135 4.097 1.00 0.00 C ATOM 1775 CG PRO A 115 11.644 8.166 2.983 1.00 0.00 C ATOM 1776 CD PRO A 115 11.153 7.182 1.954 1.00 0.00 C ATOM 0 HA PRO A 115 8.660 7.268 4.051 1.00 0.00 H new ATOM 0 HB2 PRO A 115 10.632 9.082 4.637 1.00 0.00 H new ATOM 0 HB3 PRO A 115 10.894 7.359 4.823 1.00 0.00 H new ATOM 0 HG2 PRO A 115 11.721 9.167 2.558 1.00 0.00 H new ATOM 0 HG3 PRO A 115 12.637 7.893 3.339 1.00 0.00 H new ATOM 0 HD2 PRO A 115 11.422 7.489 0.943 1.00 0.00 H new ATOM 0 HD3 PRO A 115 11.579 6.191 2.110 1.00 0.00 H new ATOM 1784 N TYR A 116 9.055 9.962 2.227 1.00 0.00 N ATOM 1785 CA TYR A 116 8.296 11.188 1.864 1.00 0.00 C ATOM 1786 C TYR A 116 7.073 10.750 1.051 1.00 0.00 C ATOM 1787 O TYR A 116 6.021 11.356 1.107 1.00 0.00 O ATOM 1788 CB TYR A 116 9.284 12.059 1.066 1.00 0.00 C ATOM 1789 CG TYR A 116 8.850 12.213 -0.373 1.00 0.00 C ATOM 1790 CD1 TYR A 116 7.678 12.912 -0.679 1.00 0.00 C ATOM 1791 CD2 TYR A 116 9.628 11.662 -1.395 1.00 0.00 C ATOM 1792 CE1 TYR A 116 7.285 13.062 -2.015 1.00 0.00 C ATOM 1793 CE2 TYR A 116 9.235 11.810 -2.729 1.00 0.00 C ATOM 1794 CZ TYR A 116 8.062 12.512 -3.039 1.00 0.00 C ATOM 1795 OH TYR A 116 7.674 12.661 -4.355 1.00 0.00 O ATOM 0 H TYR A 116 9.954 9.844 1.759 1.00 0.00 H new ATOM 0 HA TYR A 116 7.923 11.762 2.712 1.00 0.00 H new ATOM 0 HB2 TYR A 116 9.361 13.042 1.531 1.00 0.00 H new ATOM 0 HB3 TYR A 116 10.277 11.610 1.102 1.00 0.00 H new ATOM 0 HD1 TYR A 116 7.078 13.335 0.113 1.00 0.00 H new ATOM 0 HD2 TYR A 116 10.532 11.122 -1.155 1.00 0.00 H new ATOM 0 HE1 TYR A 116 6.381 13.603 -2.254 1.00 0.00 H new ATOM 0 HE2 TYR A 116 9.835 11.384 -3.520 1.00 0.00 H new ATOM 0 HH TYR A 116 8.425 12.439 -4.945 1.00 0.00 H new ATOM 1805 N GLN A 117 7.204 9.668 0.322 1.00 0.00 N ATOM 1806 CA GLN A 117 6.048 9.147 -0.465 1.00 0.00 C ATOM 1807 C GLN A 117 5.020 8.570 0.501 1.00 0.00 C ATOM 1808 O GLN A 117 3.832 8.739 0.334 1.00 0.00 O ATOM 1809 CB GLN A 117 6.616 8.055 -1.372 1.00 0.00 C ATOM 1810 CG GLN A 117 7.359 8.697 -2.546 1.00 0.00 C ATOM 1811 CD GLN A 117 6.362 9.437 -3.442 1.00 0.00 C ATOM 1812 OE1 GLN A 117 5.180 9.167 -3.404 1.00 0.00 O ATOM 1813 NE2 GLN A 117 6.795 10.359 -4.257 1.00 0.00 N ATOM 0 H GLN A 117 8.063 9.124 0.240 1.00 0.00 H new ATOM 0 HA GLN A 117 5.557 9.921 -1.056 1.00 0.00 H new ATOM 0 HB2 GLN A 117 7.293 7.415 -0.807 1.00 0.00 H new ATOM 0 HB3 GLN A 117 5.811 7.420 -1.742 1.00 0.00 H new ATOM 0 HG2 GLN A 117 8.115 9.390 -2.176 1.00 0.00 H new ATOM 0 HG3 GLN A 117 7.882 7.932 -3.121 1.00 0.00 H new ATOM 0 HE21 GLN A 117 7.789 10.586 -4.289 1.00 0.00 H new ATOM 0 HE22 GLN A 117 6.140 10.853 -4.863 1.00 0.00 H new ATOM 1822 N VAL A 118 5.474 7.903 1.525 1.00 0.00 N ATOM 1823 CA VAL A 118 4.527 7.334 2.523 1.00 0.00 C ATOM 1824 C VAL A 118 3.733 8.480 3.153 1.00 0.00 C ATOM 1825 O VAL A 118 2.517 8.473 3.169 1.00 0.00 O ATOM 1826 CB VAL A 118 5.419 6.619 3.552 1.00 0.00 C ATOM 1827 CG1 VAL A 118 4.760 6.613 4.938 1.00 0.00 C ATOM 1828 CG2 VAL A 118 5.634 5.172 3.102 1.00 0.00 C ATOM 0 H VAL A 118 6.461 7.727 1.714 1.00 0.00 H new ATOM 0 HA VAL A 118 3.802 6.641 2.096 1.00 0.00 H new ATOM 0 HB VAL A 118 6.369 7.149 3.618 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.410 6.102 5.648 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.598 7.639 5.268 1.00 0.00 H new ATOM 0 HG13 VAL A 118 3.803 6.094 4.884 1.00 0.00 H new ATOM 0 HG21 VAL A 118 6.266 4.656 3.825 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.671 4.665 3.034 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.118 5.163 2.126 1.00 0.00 H new ATOM 1838 N ASP A 119 4.410 9.479 3.652 1.00 0.00 N ATOM 1839 CA ASP A 119 3.691 10.635 4.254 1.00 0.00 C ATOM 1840 C ASP A 119 2.806 11.280 3.184 1.00 0.00 C ATOM 1841 O ASP A 119 1.680 11.675 3.437 1.00 0.00 O ATOM 1842 CB ASP A 119 4.793 11.596 4.701 1.00 0.00 C ATOM 1843 CG ASP A 119 5.601 10.958 5.834 1.00 0.00 C ATOM 1844 OD1 ASP A 119 5.046 10.790 6.908 1.00 0.00 O ATOM 1845 OD2 ASP A 119 6.760 10.649 5.607 1.00 0.00 O ATOM 0 H ASP A 119 5.428 9.543 3.668 1.00 0.00 H new ATOM 0 HA ASP A 119 3.048 10.354 5.088 1.00 0.00 H new ATOM 0 HB2 ASP A 119 5.447 11.831 3.862 1.00 0.00 H new ATOM 0 HB3 ASP A 119 4.356 12.536 5.037 1.00 0.00 H new ATOM 1850 N ALA A 120 3.308 11.371 1.984 1.00 0.00 N ATOM 1851 CA ALA A 120 2.509 11.967 0.880 1.00 0.00 C ATOM 1852 C ALA A 120 1.367 11.020 0.518 1.00 0.00 C ATOM 1853 O ALA A 120 0.230 11.422 0.367 1.00 0.00 O ATOM 1854 CB ALA A 120 3.487 12.099 -0.287 1.00 0.00 C ATOM 0 H ALA A 120 4.242 11.056 1.721 1.00 0.00 H new ATOM 0 HA ALA A 120 2.068 12.928 1.146 1.00 0.00 H new ATOM 0 HB1 ALA A 120 2.973 12.533 -1.145 1.00 0.00 H new ATOM 0 HB2 ALA A 120 4.316 12.744 0.004 1.00 0.00 H new ATOM 0 HB3 ALA A 120 3.870 11.114 -0.554 1.00 0.00 H new ATOM 1860 N ALA A 121 1.665 9.756 0.389 1.00 0.00 N ATOM 1861 CA ALA A 121 0.611 8.763 0.050 1.00 0.00 C ATOM 1862 C ALA A 121 -0.484 8.790 1.117 1.00 0.00 C ATOM 1863 O ALA A 121 -1.657 8.678 0.819 1.00 0.00 O ATOM 1864 CB ALA A 121 1.336 7.414 0.054 1.00 0.00 C ATOM 0 H ALA A 121 2.601 9.368 0.505 1.00 0.00 H new ATOM 0 HA ALA A 121 0.130 8.965 -0.907 1.00 0.00 H new ATOM 0 HB1 ALA A 121 0.629 6.620 -0.188 1.00 0.00 H new ATOM 0 HB2 ALA A 121 2.134 7.428 -0.688 1.00 0.00 H new ATOM 0 HB3 ALA A 121 1.762 7.233 1.041 1.00 0.00 H new ATOM 1870 N LEU A 122 -0.108 8.934 2.359 1.00 0.00 N ATOM 1871 CA LEU A 122 -1.130 8.961 3.443 1.00 0.00 C ATOM 1872 C LEU A 122 -2.096 10.130 3.246 1.00 0.00 C ATOM 1873 O LEU A 122 -3.295 9.944 3.246 1.00 0.00 O ATOM 1874 CB LEU A 122 -0.325 9.100 4.736 1.00 0.00 C ATOM 1875 CG LEU A 122 0.336 7.755 5.043 1.00 0.00 C ATOM 1876 CD1 LEU A 122 1.737 7.973 5.611 1.00 0.00 C ATOM 1877 CD2 LEU A 122 -0.511 6.996 6.062 1.00 0.00 C ATOM 0 H LEU A 122 0.859 9.034 2.669 1.00 0.00 H new ATOM 0 HA LEU A 122 -1.751 8.065 3.455 1.00 0.00 H new ATOM 0 HB2 LEU A 122 0.431 9.878 4.630 1.00 0.00 H new ATOM 0 HB3 LEU A 122 -0.976 9.398 5.558 1.00 0.00 H new ATOM 0 HG LEU A 122 0.412 7.178 4.121 1.00 0.00 H new ATOM 0 HD11 LEU A 122 2.197 7.008 5.825 1.00 0.00 H new ATOM 0 HD12 LEU A 122 2.345 8.511 4.884 1.00 0.00 H new ATOM 0 HD13 LEU A 122 1.670 8.555 6.530 1.00 0.00 H new ATOM 0 HD21 LEU A 122 -0.042 6.037 6.283 1.00 0.00 H new ATOM 0 HD22 LEU A 122 -0.589 7.581 6.978 1.00 0.00 H new ATOM 0 HD23 LEU A 122 -1.507 6.827 5.653 1.00 0.00 H new ATOM 1889 N ALA A 123 -1.608 11.327 3.051 1.00 0.00 N ATOM 1890 CA ALA A 123 -2.558 12.455 2.828 1.00 0.00 C ATOM 1891 C ALA A 123 -3.314 12.216 1.521 1.00 0.00 C ATOM 1892 O ALA A 123 -4.496 12.475 1.418 1.00 0.00 O ATOM 1893 CB ALA A 123 -1.706 13.720 2.735 1.00 0.00 C ATOM 0 H ALA A 123 -0.617 11.569 3.036 1.00 0.00 H new ATOM 0 HA ALA A 123 -3.291 12.544 3.630 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -2.352 14.583 2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -1.151 13.854 3.663 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -1.007 13.627 1.904 1.00 0.00 H new ATOM 1899 N GLU A 124 -2.640 11.715 0.519 1.00 0.00 N ATOM 1900 CA GLU A 124 -3.326 11.446 -0.776 1.00 0.00 C ATOM 1901 C GLU A 124 -4.466 10.449 -0.569 1.00 0.00 C ATOM 1902 O GLU A 124 -5.570 10.650 -1.032 1.00 0.00 O ATOM 1903 CB GLU A 124 -2.255 10.851 -1.689 1.00 0.00 C ATOM 1904 CG GLU A 124 -2.845 10.634 -3.082 1.00 0.00 C ATOM 1905 CD GLU A 124 -2.994 11.981 -3.790 1.00 0.00 C ATOM 1906 OE1 GLU A 124 -2.086 12.788 -3.682 1.00 0.00 O ATOM 1907 OE2 GLU A 124 -4.016 12.185 -4.426 1.00 0.00 O ATOM 0 H GLU A 124 -1.647 11.482 0.542 1.00 0.00 H new ATOM 0 HA GLU A 124 -3.762 12.349 -1.203 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -1.396 11.519 -1.745 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -1.897 9.906 -1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -2.199 9.975 -3.663 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -3.815 10.143 -3.005 1.00 0.00 H new ATOM 1914 N PHE A 125 -4.209 9.365 0.123 1.00 0.00 N ATOM 1915 CA PHE A 125 -5.290 8.367 0.352 1.00 0.00 C ATOM 1916 C PHE A 125 -6.450 9.015 1.106 1.00 0.00 C ATOM 1917 O PHE A 125 -7.600 8.855 0.747 1.00 0.00 O ATOM 1918 CB PHE A 125 -4.651 7.254 1.183 1.00 0.00 C ATOM 1919 CG PHE A 125 -5.620 6.104 1.302 1.00 0.00 C ATOM 1920 CD1 PHE A 125 -6.730 6.213 2.147 1.00 0.00 C ATOM 1921 CD2 PHE A 125 -5.410 4.931 0.568 1.00 0.00 C ATOM 1922 CE1 PHE A 125 -7.630 5.147 2.259 1.00 0.00 C ATOM 1923 CE2 PHE A 125 -6.310 3.865 0.682 1.00 0.00 C ATOM 1924 CZ PHE A 125 -7.418 3.973 1.529 1.00 0.00 C ATOM 0 H PHE A 125 -3.305 9.133 0.534 1.00 0.00 H new ATOM 0 HA PHE A 125 -5.697 7.979 -0.582 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.726 6.919 0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.389 7.628 2.173 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -6.892 7.119 2.712 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -4.554 4.848 -0.086 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -8.488 5.231 2.909 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.149 2.959 0.116 1.00 0.00 H new ATOM 0 HZ PHE A 125 -8.110 3.149 1.619 1.00 0.00 H new ATOM 1934 N LEU A 126 -6.162 9.759 2.139 1.00 0.00 N ATOM 1935 CA LEU A 126 -7.259 10.424 2.892 1.00 0.00 C ATOM 1936 C LEU A 126 -7.985 11.417 1.989 1.00 0.00 C ATOM 1937 O LEU A 126 -9.197 11.486 1.966 1.00 0.00 O ATOM 1938 CB LEU A 126 -6.564 11.162 4.030 1.00 0.00 C ATOM 1939 CG LEU A 126 -5.831 10.159 4.914 1.00 0.00 C ATOM 1940 CD1 LEU A 126 -5.141 10.903 6.059 1.00 0.00 C ATOM 1941 CD2 LEU A 126 -6.843 9.160 5.480 1.00 0.00 C ATOM 0 H LEU A 126 -5.221 9.933 2.491 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.001 9.713 3.255 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -5.860 11.891 3.629 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -7.295 11.715 4.619 1.00 0.00 H new ATOM 0 HG LEU A 126 -5.081 9.626 4.330 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -4.616 10.189 6.693 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -4.427 11.618 5.650 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -5.887 11.433 6.651 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -6.327 8.439 6.114 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -7.589 9.693 6.070 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -7.335 8.636 4.660 1.00 0.00 H new ATOM 1953 N ARG A 127 -7.245 12.184 1.244 1.00 0.00 N ATOM 1954 CA ARG A 127 -7.876 13.178 0.340 1.00 0.00 C ATOM 1955 C ARG A 127 -8.787 12.472 -0.664 1.00 0.00 C ATOM 1956 O ARG A 127 -9.845 12.959 -1.006 1.00 0.00 O ATOM 1957 CB ARG A 127 -6.702 13.847 -0.371 1.00 0.00 C ATOM 1958 CG ARG A 127 -7.211 15.043 -1.173 1.00 0.00 C ATOM 1959 CD ARG A 127 -6.031 15.730 -1.864 1.00 0.00 C ATOM 1960 NE ARG A 127 -6.634 16.856 -2.629 1.00 0.00 N ATOM 1961 CZ ARG A 127 -7.289 16.622 -3.738 1.00 0.00 C ATOM 1962 NH1 ARG A 127 -7.448 15.398 -4.159 1.00 0.00 N ATOM 1963 NH2 ARG A 127 -7.795 17.612 -4.415 1.00 0.00 N ATOM 0 H ARG A 127 -6.225 12.165 1.223 1.00 0.00 H new ATOM 0 HA ARG A 127 -8.497 13.898 0.873 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -5.959 14.173 0.357 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -6.209 13.135 -1.032 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -7.940 14.715 -1.914 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -7.721 15.746 -0.514 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -5.304 16.092 -1.137 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -5.505 15.041 -2.525 1.00 0.00 H new ATOM 0 HE ARG A 127 -6.536 17.812 -2.288 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -7.062 14.620 -3.624 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -7.959 15.218 -5.023 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -7.681 18.569 -4.081 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -8.306 17.431 -5.279 1.00 0.00 H new ATOM 1977 N LEU A 128 -8.381 11.331 -1.150 1.00 0.00 N ATOM 1978 CA LEU A 128 -9.225 10.607 -2.141 1.00 0.00 C ATOM 1979 C LEU A 128 -10.181 9.629 -1.456 1.00 0.00 C ATOM 1980 O LEU A 128 -11.127 9.161 -2.058 1.00 0.00 O ATOM 1981 CB LEU A 128 -8.234 9.866 -3.037 1.00 0.00 C ATOM 1982 CG LEU A 128 -7.870 10.754 -4.225 1.00 0.00 C ATOM 1983 CD1 LEU A 128 -7.396 12.118 -3.719 1.00 0.00 C ATOM 1984 CD2 LEU A 128 -6.751 10.094 -5.032 1.00 0.00 C ATOM 0 H LEU A 128 -7.505 10.871 -0.905 1.00 0.00 H new ATOM 0 HA LEU A 128 -9.858 11.291 -2.706 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -7.338 9.608 -2.473 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.671 8.931 -3.387 1.00 0.00 H new ATOM 0 HG LEU A 128 -8.747 10.887 -4.859 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.136 12.751 -4.568 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -8.193 12.590 -3.145 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -6.520 11.986 -3.084 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -6.491 10.728 -5.880 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -5.875 9.960 -4.397 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.088 9.123 -5.395 1.00 0.00 H new ATOM 1996 N ALA A 129 -9.949 9.302 -0.214 1.00 0.00 N ATOM 1997 CA ALA A 129 -10.860 8.342 0.470 1.00 0.00 C ATOM 1998 C ALA A 129 -12.289 8.893 0.498 1.00 0.00 C ATOM 1999 O ALA A 129 -12.501 10.020 0.898 1.00 0.00 O ATOM 2000 CB ALA A 129 -10.325 8.212 1.890 1.00 0.00 C ATOM 0 H ALA A 129 -9.176 9.654 0.351 1.00 0.00 H new ATOM 0 HA ALA A 129 -10.891 7.381 -0.044 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -10.950 7.518 2.452 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -9.302 7.837 1.860 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -10.340 9.188 2.375 1.00 0.00 H new ATOM 2006 N PRO A 130 -13.232 8.082 0.088 1.00 0.00 N ATOM 2007 CA PRO A 130 -12.933 6.708 -0.395 1.00 0.00 C ATOM 2008 C PRO A 130 -12.327 6.767 -1.804 1.00 0.00 C ATOM 2009 O PRO A 130 -12.965 7.193 -2.745 1.00 0.00 O ATOM 2010 CB PRO A 130 -14.297 6.028 -0.413 1.00 0.00 C ATOM 2011 CG PRO A 130 -15.285 7.142 -0.548 1.00 0.00 C ATOM 2012 CD PRO A 130 -14.665 8.379 0.046 1.00 0.00 C ATOM 0 HA PRO A 130 -12.212 6.177 0.227 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -14.377 5.327 -1.244 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -14.466 5.459 0.501 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -15.536 7.306 -1.596 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -16.213 6.894 -0.033 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -14.871 9.259 -0.563 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -15.058 8.582 1.042 1.00 0.00 H new ATOM 2020 N VAL A 131 -11.095 6.351 -1.957 1.00 0.00 N ATOM 2021 CA VAL A 131 -10.457 6.395 -3.306 1.00 0.00 C ATOM 2022 C VAL A 131 -11.150 5.417 -4.251 1.00 0.00 C ATOM 2023 O VAL A 131 -11.831 4.504 -3.825 1.00 0.00 O ATOM 2024 CB VAL A 131 -8.998 5.971 -3.093 1.00 0.00 C ATOM 2025 CG1 VAL A 131 -8.269 7.017 -2.252 1.00 0.00 C ATOM 2026 CG2 VAL A 131 -8.955 4.622 -2.373 1.00 0.00 C ATOM 0 H VAL A 131 -10.506 5.984 -1.209 1.00 0.00 H new ATOM 0 HA VAL A 131 -10.530 7.388 -3.750 1.00 0.00 H new ATOM 0 HB VAL A 131 -8.508 5.884 -4.063 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -7.234 6.709 -2.105 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -8.292 7.978 -2.766 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -8.760 7.112 -1.284 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -7.918 4.323 -2.223 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -9.451 4.710 -1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -9.466 3.871 -2.976 1.00 0.00 H new ATOM 2036 N GLU A 132 -10.971 5.591 -5.526 1.00 0.00 N ATOM 2037 CA GLU A 132 -11.601 4.659 -6.494 1.00 0.00 C ATOM 2038 C GLU A 132 -10.603 3.557 -6.848 1.00 0.00 C ATOM 2039 O GLU A 132 -9.743 3.736 -7.688 1.00 0.00 O ATOM 2040 CB GLU A 132 -11.916 5.518 -7.716 1.00 0.00 C ATOM 2041 CG GLU A 132 -13.366 5.281 -8.138 1.00 0.00 C ATOM 2042 CD GLU A 132 -13.823 6.412 -9.061 1.00 0.00 C ATOM 2043 OE1 GLU A 132 -12.998 6.912 -9.806 1.00 0.00 O ATOM 2044 OE2 GLU A 132 -14.991 6.757 -9.006 1.00 0.00 O ATOM 0 H GLU A 132 -10.415 6.339 -5.940 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.497 4.176 -6.103 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -11.760 6.572 -7.485 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.241 5.268 -8.535 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.455 4.322 -8.649 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -14.008 5.234 -7.259 1.00 0.00 H new ATOM 2051 N THR A 133 -10.699 2.424 -6.207 1.00 0.00 N ATOM 2052 CA THR A 133 -9.741 1.321 -6.506 1.00 0.00 C ATOM 2053 C THR A 133 -9.982 0.776 -7.913 1.00 0.00 C ATOM 2054 O THR A 133 -9.087 0.249 -8.541 1.00 0.00 O ATOM 2055 CB THR A 133 -10.003 0.248 -5.449 1.00 0.00 C ATOM 2056 OG1 THR A 133 -11.400 0.159 -5.191 1.00 0.00 O ATOM 2057 CG2 THR A 133 -9.251 0.614 -4.166 1.00 0.00 C ATOM 0 H THR A 133 -11.396 2.215 -5.492 1.00 0.00 H new ATOM 0 HA THR A 133 -8.706 1.661 -6.475 1.00 0.00 H new ATOM 0 HB THR A 133 -9.652 -0.719 -5.810 1.00 0.00 H new ATOM 0 HG1 THR A 133 -11.544 -0.124 -4.264 1.00 0.00 H new ATOM 0 HG21 THR A 133 -9.433 -0.147 -3.408 1.00 0.00 H new ATOM 0 HG22 THR A 133 -8.183 0.670 -4.374 1.00 0.00 H new ATOM 0 HG23 THR A 133 -9.601 1.580 -3.802 1.00 0.00 H new ATOM 2065 N MET A 134 -11.180 0.905 -8.414 1.00 0.00 N ATOM 2066 CA MET A 134 -11.472 0.399 -9.789 1.00 0.00 C ATOM 2067 C MET A 134 -11.237 -1.109 -9.865 1.00 0.00 C ATOM 2068 O MET A 134 -10.903 -1.649 -10.900 1.00 0.00 O ATOM 2069 CB MET A 134 -10.503 1.163 -10.688 1.00 0.00 C ATOM 2070 CG MET A 134 -10.678 2.657 -10.421 1.00 0.00 C ATOM 2071 SD MET A 134 -12.294 3.198 -11.032 1.00 0.00 S ATOM 2072 CE MET A 134 -11.821 3.418 -12.765 1.00 0.00 C ATOM 0 H MET A 134 -11.969 1.338 -7.933 1.00 0.00 H new ATOM 0 HA MET A 134 -12.509 0.555 -10.086 1.00 0.00 H new ATOM 0 HB2 MET A 134 -9.476 0.859 -10.485 1.00 0.00 H new ATOM 0 HB3 MET A 134 -10.700 0.939 -11.736 1.00 0.00 H new ATOM 0 HG2 MET A 134 -10.596 2.858 -9.353 1.00 0.00 H new ATOM 0 HG3 MET A 134 -9.885 3.220 -10.913 1.00 0.00 H new ATOM 0 HE1 MET A 134 -11.711 4.481 -12.980 1.00 0.00 H new ATOM 0 HE2 MET A 134 -10.874 2.911 -12.951 1.00 0.00 H new ATOM 0 HE3 MET A 134 -12.592 2.995 -13.409 1.00 0.00 H new ATOM 2082 N ALA A 135 -11.429 -1.788 -8.768 1.00 0.00 N ATOM 2083 CA ALA A 135 -11.243 -3.269 -8.757 1.00 0.00 C ATOM 2084 C ALA A 135 -12.605 -3.964 -8.654 1.00 0.00 C ATOM 2085 O ALA A 135 -12.711 -5.090 -9.112 1.00 0.00 O ATOM 2086 CB ALA A 135 -10.397 -3.568 -7.517 1.00 0.00 C ATOM 2087 OXT ALA A 135 -13.517 -3.357 -8.117 1.00 0.00 O ATOM 0 H ALA A 135 -11.708 -1.381 -7.875 1.00 0.00 H new ATOM 0 HA ALA A 135 -10.761 -3.628 -9.667 1.00 0.00 H new ATOM 0 HB1 ALA A 135 -10.221 -4.641 -7.447 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -9.442 -3.048 -7.594 1.00 0.00 H new ATOM 0 HB3 ALA A 135 -10.924 -3.227 -6.626 1.00 0.00 H new